ML753286
ML753286 structure
|
Common Name | ML753286 | ||
|---|---|---|---|---|
| CAS Number | 1699720-89-2 | Molecular Weight | 355.43 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C20H25N3O3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Use of ML753286ML753286 is an orally active and selective BCRP (Breast cancer resistance protein) inhibitor with an IC50 of 0.6 μM. ML753286 has high permeability and low to medium clearance in rodent and human liver S9 fractions, and is stable in plasma cross species[1]. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | ML753286 |
|---|
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | ML753286 is an orally active and selective BCRP (Breast cancer resistance protein) inhibitor with an IC50 of 0.6 μM. ML753286 has high permeability and low to medium clearance in rodent and human liver S9 fractions, and is stable in plasma cross species[1]. |
|---|---|
| Related Catalog | |
| Target |
IC50: 0.6 μM (BCRP)[1] |
| In Vitro | ML753286 has IC50 values of >30, 0.6, and 39.0 μM for the inhibition of P-gp-, BCRP-, and OATP mediated transport, respectively[1]. |
| In Vivo | ML753286 (25- or 50-mg/kg (PO); 10 or 20 mg/kg (IV); 0.083-24 hours) appears to completely inhibit Bcrp functions in rats at 25 mg/kg PO or at 20 mg/kg IV. The tmax values in plasma were 1.4, 4.0, and 4.1 hours in Bcrp KO rats, WT rats pre-administered 25-mg/kg ML753286, and WT rats pre-administered 50-mg/kg ML753286, respectively[1]. Animal Model: Male Bcrp KO (Abcg2−/−) and WT (Wistar) Rats[1] Dosage: 25- or 50-mg/kg (PO); 10 or 20 mg/kg (IV) (Pharmacokinetic Study) Administration: PO or IV; 0.083, 0.25, 0.5, 1, 2, 4, 6, 8, and 24 hours Result: The tmax values in plasma were 1.4, 4.0, and 4.1 hours in Bcrp KO rats, WT rats pre-administered 25-mg/kg ML753286, and WT rats pre-administered 50-mg/kg ML753286, respectively. |
| 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 | C20H25N3O3 |
|---|---|
| Molecular Weight | 355.43 |
| InChIKey | XDVXQQDQFWVCAU-MZPVMMEZSA-N |
| SMILES | COc1ccc2c3c([nH]c2c1)C(CC(C)C)N1C(=O)C(C)NC(=O)C1C3 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of ML753286? |
| A: The English name of ML753286 is ML753286. |
| Q: What are the uses of ML753286? |
| A: Main uses of ML753286: ML753286 is an orally active and selective BCRP (Breast cancer resistance protein) inhibitor with an IC50 of 0.6 μM. ML753286 has high permeability and low to medium clearance in rodent and human liver S9 fractions, and is stable in plasma cross species[1]. |
| Q: What is the CAS number of ML753286? |
| A: CAS number of ML753286 is 1699720-89-2. |
| Q: What is the molecular weight of ML753286? |
| A: Molecular weight of ML753286 is 355.43. |
| Q: What is the SMILES notation of ML753286? |
| A: SMILES notation of ML753286 is COc1ccc2c3c([nH]c2c1)C(CC(C)C)N1C(=O)C(C)NC(=O)C1C3. |
| Q: What is the Chinese name of 1699720-89-2? |
| A: Chinese name of 1699720-89-2 is ML753286. |
| Q: What is the molecular formula of ML753286? |
| A: Molecular formula of ML753286 is C20H25N3O3. |
| Q: What is the InChIKey of ML753286? |
| A: InChIKey of ML753286 is XDVXQQDQFWVCAU-MZPVMMEZSA-N. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |