(-)-MDL 100907
(-)-MDL 100907 structure
|
Common Name | (-)-MDL 100907 | ||
|---|---|---|---|---|
| CAS Number | 175673-57-1 | Molecular Weight | 373.46 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C22H28FNO3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Use of (-)-MDL 100907(S)-Volinanserin is an isform of Volinanserin (HY-14940). Volinanserin is a potent and selective antagonist of 5-HT2 receptor, with a Ki of 0.36 nM, and shows 300-fold selectivity for 5-HT2 receptor over 5-HT1c, alpha-1 and DA D2 receptors. Volinanserin has antipsychotic activity. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | (S)-Volinanserin is an isform of Volinanserin (HY-14940). Volinanserin is a potent and selective antagonist of 5-HT2 receptor, with a Ki of 0.36 nM, and shows 300-fold selectivity for 5-HT2 receptor over 5-HT1c, alpha-1 and DA D2 receptors. Volinanserin has antipsychotic activity. |
|---|---|
| Related Catalog | |
| Target |
Ki: 0.36 nM (5-HT2 receptor)[1] |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C22H28FNO3 |
|---|---|
| Molecular Weight | 373.46 |
| Exact Mass | 373.20500 |
| PSA | 41.93000 |
| LogP | 3.76890 |
| InChIKey | HXTGXYRHXAGCFP-NRFANRHFSA-N |
| SMILES | COc1cccc(C(O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC |
| Storage condition | -20°C |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~98%
(-)-MDL 100907 CAS#:175673-57-1 |
| Literature: Ullrich, Thomas; Rice, Kenner C. Bioorganic and Medicinal Chemistry, 2000 , vol. 8, # 10 p. 2427 - 2432 |
|
~%
(-)-MDL 100907 CAS#:175673-57-1 |
| Literature: Morris, David J.; Hayes, Aidan M.; Wills, Martin Journal of Organic Chemistry, 2006 , vol. 71, # 18 p. 7035 - 7044 |
|
~%
(-)-MDL 100907 CAS#:175673-57-1 |
| Literature: Morris, David J.; Hayes, Aidan M.; Wills, Martin Journal of Organic Chemistry, 2006 , vol. 71, # 18 p. 7035 - 7044 |
|
~%
(-)-MDL 100907 CAS#:175673-57-1 |
| Literature: Morris, David J.; Hayes, Aidan M.; Wills, Martin Journal of Organic Chemistry, 2006 , vol. 71, # 18 p. 7035 - 7044 |
|
~%
(-)-MDL 100907 CAS#:175673-57-1 |
| Literature: Morris, David J.; Hayes, Aidan M.; Wills, Martin Journal of Organic Chemistry, 2006 , vol. 71, # 18 p. 7035 - 7044 |
|
~%
(-)-MDL 100907 CAS#:175673-57-1 |
| Literature: Ullrich, Thomas; Rice, Kenner C. Bioorganic and Medicinal Chemistry, 2000 , vol. 8, # 10 p. 2427 - 2432 |
|
~%
(-)-MDL 100907 CAS#:175673-57-1 |
| Literature: Huang, Yiyun; Mahmood, Khalid; Mathis, Chester A. Journal of Labelled Compounds and Radiopharmaceuticals, 1999 , vol. 42, # 10 p. 949 - 957 |
![1-[2-(4-fluorophenyl)-ethyl]-piperidine-4-carboxylic acid ethyl ester structure](https://image.chemsrc.com/caspic/318/175553-31-8.png)
![1-[2-(4-fluorophenyl)ethyl]-4-piperidinecarboxylic acid N-methoxy N-methyl amide structure](https://image.chemsrc.com/caspic/280/175553-32-9.png)
![(+/-)-ALPHA-(2,3-DIMETHOXY-PHENYL)-1-[2-(4-FLUOROPHENYL)ETHYL]-4-PIPERIDINE-METHANOL structure](https://image.chemsrc.com/caspic/101/139290-69-0.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 1 | |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| (S)-(2,3-dimethoxyphenyl)-{1-[2-(4-fluorophenyl)-ethyl]-piperidin-4-yl}-methanol |
| (R)-(2,3-dimethoxyphenyl)-{1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methanol |
| (S)-(+)-Tricyclamoliodid |
| 1-[(3s)-3-cyclohexyl-3-hydroxy-3-phenylpropyl]-1-methylpyrrolidinium iodide |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol? |
| A: Molecular weight of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol is 373.46. |
| Q: What are the upstream materials of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol? |
| A: Related upstream materials(CAS) of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol: 332-42-3;311348-76-2;7589-27-7;175553-31-8;140235-25-2;139290-69-0. |
| Q: What is the LogP of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol? |
| A: LogP of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol is 3.76890. |
| Q: What is the polar surface area (PSA) of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol? |
| A: Polar surface area (PSA) of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol is 41.93000. |
| Q: What is the molecular formula of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol? |
| A: Molecular formula of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol is C22H28FNO3. |
| Q: What is the English name of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol? |
| A: The English name of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol is (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol. |
| Q: What is the InChIKey of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol? |
| A: InChIKey of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol is HXTGXYRHXAGCFP-NRFANRHFSA-N. |
| Q: What is the SMILES notation of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol? |
| A: SMILES notation of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol is COc1cccc(C(O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC. |
| Q: What is the CAS number of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol? |
| A: CAS number of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol is 175673-57-1. |
| Q: What are the uses of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol? |
| A: Main uses of (S)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]-4-piperidin yl}methanol: (S)-Volinanserin is an isform of Volinanserin (HY-14940). Volinanserin is a potent and selective antagonist of 5-HT2 receptor, with a Ki of 0.36 nM, and shows 300-fold selectivity for 5-HT2 receptor over 5-HT1c, alpha-1 and DA D2 receptors. Volinanserin has antipsychotic activity. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |