3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide
TL;DR: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide (CAS 849040-63-7) is a chemical compound with molecular formula C19H22ClN3O3S and molecular weight 407.11 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-(pyridin-4-ylmethyl)benzamide
Also Known As: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide, 3-(AZEPANE-1-SULFONYL)-4-CHLORO-N-(PYRIDIN-4-YLMETHYL)BENZAMIDE
| Molecular Formula | C19H22ClN3O3S |
|---|---|
| Molecular Weight | 407.11 g/mol |
| LogP | 3.2297 |
| Topological Polar Surface Area | 79.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.10703 |
| Heavy Atoms | 27 |
| Complexity | 895.67084 |
Chemical Identifiers
| CAS Number | 849040-63-7 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC=NC=C3)Cl |
Product Overview
3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide (CAS 849040-63-7), with molecular formula C19H22ClN3O3S and molecular weight 407.11 g/mol. IUPAC: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide.
Chemical Property Profile of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide
Property Insights of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide
The XLogP value of 3.2297 indicates that 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide. Following Lipinski's Rule of Five, 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide 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 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide?
The CAS number of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide is 849040-63-7.
What is the molecular formula of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide?
The molecular formula of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide is C19H22ClN3O3S.
What is the molecular weight of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide?
The molecular weight of 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide is 407.11 g/mol.
Where can I buy 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide?
You can request a quote for 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)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-(pyridin-4-ylmethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(azepan-1-ylsulfonyl)-4-chloro-N-(pyridin-4-ylmethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.