Piribedil structure
|
Common Name | Piribedil | ||
|---|---|---|---|---|
| CAS Number | 3605-01-4 | Molecular Weight | 298.340 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 469.4±55.0 °C at 760 mmHg | |
| Molecular Formula | C16H18N4O2 | Melting Point | 98 °C | |
| MSDS | N/A | Flash Point | 237.7±31.5 °C | |
Use of PiribedilPiribedil is a dopamine D2 receptor (D2R) agonist which also displays antagonist property at hα1A-adrenoceptor (hα1A-AR). |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | Piribedil is a dopamine D2 receptor (D2R) agonist which also displays antagonist property at hα1A-adrenoceptor (hα1A-AR). |
|---|---|
| Related Catalog | |
| Target |
D2R, hα1A-AR[1] |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 469.4±55.0 °C at 760 mmHg |
| Melting Point | 98 °C |
| Molecular Formula | C16H18N4O2 |
| Molecular Weight | 298.340 |
| Flash Point | 237.7±31.5 °C |
| Exact Mass | 298.142975 |
| PSA | 50.72000 |
| LogP | 2.36 |
| Vapour Pressure | 0.0±1.2 mmHg at 25°C |
| Index of Refraction | 1.632 |
| InChIKey | OQDPVLVUJFGPGQ-UHFFFAOYSA-N |
| SMILES | c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1 |
| Storage condition | 2-8°C |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
|
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| HS Code | 2934999090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~99%
Piribedil CAS#:3605-01-4 |
| Literature: Peishan, Siah; Dang, Tuan Thanh; Seayad, Abdul Majeed; Ramalingam, Balamurugan ChemCatChem, 2014 , vol. 6, # 3 p. 808 - 814 |
|
~74%
Piribedil CAS#:3605-01-4 |
| Literature: Duncton, Matthew A. J.; Roffey, Jonathan R. A.; Hamlyn, Richard J.; Adams, David R. Tetrahedron Letters, 2006 , vol. 47, # 15 p. 2549 - 2552 |
|
~54%
Piribedil CAS#:3605-01-4 |
| Literature: Chilmonczyk; Cybulski; Krajewski; Szelejewski Archiv der Pharmazie, 1993 , vol. 326, # 4 p. 241 - 242 |
|
~54%
Piribedil CAS#:3605-01-4 |
| Literature: Chilmonczyk; Cybulski; Krajewski; Szelejewski Archiv der Pharmazie, 1993 , vol. 326, # 4 p. 241 - 242 |
|
~%
Piribedil CAS#:3605-01-4 |
| Literature: Tetrahedron Letters, , vol. 47, # 15 p. 2549 - 2552 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine |
| 2-(4-(Benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)pyrimidine |
| Piribedilum [INN-Latin] |
| 1-(2''-Pyrimidyl)-4-(methylene-3',4'-dioxybenzyl)piperazine |
| 2-(4-Benzo[1,3]dioxol-5-ylmethyl-piperazin-1-yl)-pyrimidine |
| Piribedile [DCIT] |
| 3-benzodioxol-5-ylmethyl)-1-piperazinyl]pyrimidine |
| 2-[4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazinyl]pyrimidine |
| Piribedil |
| ET 495 |
| Trivastal |
| MFCD00868264 |
| Trivastan |
| EU-4200 |
| EINECS 222-764-6 |
| 2-[4-(3,4-Methylenedioxybenzyl)piperazino]pyrimidine |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine? |
| A: SMILES notation of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine is c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1. |
| Q: What is the LogP of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine? |
| A: LogP of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine is 2.36. |
| Q: What is the boiling point of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine? |
| A: Boiling point of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine is 469.4±55.0 °C at 760 mmHg. |
| Q: What is the InChIKey of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine? |
| A: InChIKey of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine is OQDPVLVUJFGPGQ-UHFFFAOYSA-N. |
| Q: What is the polar surface area (PSA) of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine? |
| A: Polar surface area (PSA) of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine is 50.72000. |
| Q: What is the molecular formula of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine? |
| A: Molecular formula of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine is C16H18N4O2. |
| Q: What is the CAS number of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine? |
| A: CAS number of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine is 3605-01-4. |
| Q: What is the molecular weight of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine? |
| A: Molecular weight of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine is 298.340. |
| Q: What is the melting point of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine? |
| A: Melting point of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine is 98 °C. |
| Q: What is the English name of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine? |
| A: The English name of 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine is 2-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Henan Tianfu Chemical Co., Ltd. |
| Zhongshan Xingrui Chemical Co. , Ltd. |