RefChem:1065046
TL;DR: RefChem:1065046 (CAS 50691-95-7) is a chemical compound with molecular formula C17H15ClN2O2 and molecular weight 314.0822 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R)-7-chloro-3-(1-hydroxyethyl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
Also Known As: 5-25-02-00281 (Beilstein Handbook Reference), 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(1-hydroxyethyl)-5-phenyl-, (R-(R*,S*))-, (R-(R*,S*))-1,3-Dihydro-7-chloro-3-(1-hydroxyethyl)-5-phenyl-2H-1,4-benzodiazepin-2-one, 7-Chloro-3-(1-hydroxyethyl)-5-phenyl-3H-1,4-benzodiazepin-2-ol, (3R)-7-Chloro-3-(1-hydroxyethyl)-5-phenyl-3H-1,4-benzodiazepin-2-ol
Technical Specifications
| Molecular Formula | C17H15ClN2O2 |
| Molecular Weight | 314.0822 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 61.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.0822 Da |
| Heavy Atoms | 22 |
| Complexity | 448.0 |
| SMILES | CC([C@@H]1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)O |
| InChIKey | NBQFGUFYJOXGIE-GENIYJEYSA-N |
Chemical Property Profile of RefChem:1065046
Property Insights of RefChem:1065046
The XLogP value of 3.3 indicates that RefChem:1065046 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1065046. Following Lipinski's Rule of Five, RefChem:1065046 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1065046?
The CAS number of RefChem:1065046 is 50691-95-7.
What is the molecular formula of RefChem:1065046?
The molecular formula of RefChem:1065046 is C17H15ClN2O2.
What is the molecular weight of RefChem:1065046?
The molecular weight of RefChem:1065046 is 314.0822 g/mol.
Where can I buy RefChem:1065046?
You can request a quote for RefChem:1065046 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1065046?
Yes, CoreyChem provides custom synthesis services for RefChem:1065046 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.