4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide
TL;DR: 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide (CAS 159970-36-2) is a chemical compound with molecular formula C13H15ClN2O2 and molecular weight 266.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(2-oxoazepan-3-yl)benzamide
Also Known As: 3-(4'-Chlorobenzoylamino)azepan-2-one, 4-chloro-N-(2-oxoazepan-3-yl)benzamide, 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide, Benzamide, 4-chloro-N-(hexahydro-2-oxo-1H-azepin-3-yl)-
| Molecular Formula | C13H15ClN2O2 |
|---|---|
| Molecular Weight | 266.08 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.0822 |
| Heavy Atoms | 18 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 159970-36-2 |
|---|---|
| SMILES | C1CCNC(=O)C(C1)NC(=O)C2=CC=C(C=C2)Cl |
| InChIKey | GXOVVNALDZHXRV-UHFFFAOYSA-N |
Product Overview
4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide (CAS 159970-36-2), with molecular formula C13H15ClN2O2 and molecular weight 266.08 g/mol. IUPAC: 4-chloro-N-(2-oxoazepan-3-yl)benzamide.
Chemical Property Profile of 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide
Property Insights of 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide. With a topological polar surface area (TPSA) of 58.2 Ų, 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide has 2 hydrogen bond donor(s) and 2 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 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide?
The CAS number of 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide is 159970-36-2.
What is the molecular formula of 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide?
The molecular formula of 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide is C13H15ClN2O2.
What is the molecular weight of 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide?
The molecular weight of 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide is 266.08 g/mol.
Where can I buy 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide?
You can request a quote for 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-N-(2-oxo-azepan-3-yl)-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.