3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide
TL;DR: 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide (CAS 330461-34-2) is a chemical compound with molecular formula C20H23ClN2O3S and molecular weight 406.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide
Also Known As: 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide, BAS 00680131, 3-(AZEPANE-1-SULFONYL)-N-BENZYL-4-CHLOROBENZAMIDE, 3-(1-azepanylsulfonyl)-N-benzyl-4-chlorobenzamide, 3-(Azepane-1-sulfonyl)-N-benzyl-4-chloro-benzamide
| Molecular Formula | C20H23ClN2O3S |
|---|---|
| Molecular Weight | 406.11 g/mol |
| LogP | 3.8347 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.1118 |
| Heavy Atoms | 27 |
| Complexity | 892.69775 |
Chemical Identifiers
| CAS Number | 330461-34-2 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC=CC=C3)Cl |
Product Overview
3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide (CAS 330461-34-2), with molecular formula C20H23ClN2O3S and molecular weight 406.11 g/mol. IUPAC: 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide.
Chemical Property Profile of 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide
Property Insights of 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide
The XLogP value of 3.8347 indicates that 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide. Following Lipinski's Rule of Five, 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide has 1 hydrogen bond donor(s) and 3 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)-N-benzyl-4-chlorobenzamide?
The CAS number of 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide is 330461-34-2.
What is the molecular formula of 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide?
The molecular formula of 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide is C20H23ClN2O3S.
What is the molecular weight of 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide?
The molecular weight of 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide is 406.11 g/mol.
Where can I buy 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide?
You can request a quote for 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide 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)-N-benzyl-4-chlorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(azepan-1-ylsulfonyl)-N-benzyl-4-chlorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.