3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide
TL;DR: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide (CAS 438021-95-5) is a chemical compound with molecular formula C19H28ClN3O4S and molecular weight 429.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide
Also Known As: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide, 4-Chloro-3-[(hexahydro-1H-azepin-1-yl)sulfonyl]-N-[2-(4-morpholinyl)ethyl]benzamide, 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(morpholin-4-yl)ethyl]benzamide, 3-(1-azepanylsulfonyl)-4-chloro-N-[2-(4-morpholinyl)ethyl]benzamide, 3-(AZEPANE-1-SULFONYL)-4-CHLORO-N-[2-(MORPHOLIN-4-YL)ETHYL]BENZAMIDE
| Molecular Formula | C19H28ClN3O4S |
|---|---|
| Molecular Weight | 429.15 g/mol |
| LogP | 1.9667 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.1489 |
| Heavy Atoms | 28 |
| Complexity | 773.3835 |
Chemical Identifiers
| CAS Number | 438021-95-5 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCN3CCOCC3)Cl |
Product Overview
3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide (CAS 438021-95-5), with molecular formula C19H28ClN3O4S and molecular weight 429.15 g/mol. IUPAC: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide.
Chemical Property Profile of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide
Property Insights of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide
The XLogP value of 1.9667 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide. The TPSA of 78.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide. Following Lipinski's Rule of Five, 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide has 1 hydrogen bond donor(s) and 5 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 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide?
The CAS number of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide is 438021-95-5.
What is the molecular formula of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide?
The molecular formula of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide is C19H28ClN3O4S.
What is the molecular weight of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide?
The molecular weight of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide is 429.15 g/mol.
Where can I buy 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide?
You can request a quote for 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-morpholin-4-ylethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.