ChemDiv1_023601
TL;DR: ChemDiv1_023601 (CAS 1760-44-7) is a chemical compound with molecular formula C17H14N2O3 and molecular weight 294.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) acetate
Also Known As: ChemDiv1_023601, (2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) acetate, 2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-3-yl acetate, 2-Oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl acetate, ACETIC ACID 2-OXO-5-PHENYL-2,3-DIHYDRO-1H-BENZO[E][1,4]DIAZEPIN-3-YL ESTER
| Molecular Formula | C17H14N2O3 |
|---|---|
| Molecular Weight | 294.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.10043 |
| Heavy Atoms | 22 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 1760-44-7 |
|---|---|
| SMILES | CC(=O)OC1C(=O)NC2=CC=CC=C2C(=N1)C3=CC=CC=C3 |
| InChIKey | XDQDVCJNJFUBLE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
ChemDiv1_023601 (CAS 1760-44-7), with molecular formula C17H14N2O3 and molecular weight 294.10 g/mol. IUPAC: (2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) acetate.
Chemical Property Profile of ChemDiv1_023601
Property Insights of ChemDiv1_023601
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_023601. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_023601. Following Lipinski's Rule of Five, ChemDiv1_023601 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_023601?
The CAS number of ChemDiv1_023601 is 1760-44-7.
What is the molecular formula of ChemDiv1_023601?
The molecular formula of ChemDiv1_023601 is C17H14N2O3.
What is the molecular weight of ChemDiv1_023601?
The molecular weight of ChemDiv1_023601 is 294.10 g/mol.
Where can I buy ChemDiv1_023601?
You can request a quote for ChemDiv1_023601 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023601?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023601 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.