3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide
TL;DR: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide (CAS 853702-18-8) is a chemical compound with molecular formula C19H23ClN2O3S2 and molecular weight 426.08 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-methyl-N-(thiophen-2-ylmethyl)benzamide
Also Known As: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide, 3-(azepane-1-sulfonyl)-4-chloro-N-methyl-N-[(thiophen-2-yl)methyl]benzamide
| Molecular Formula | C19H23ClN2O3S2 |
|---|---|
| Molecular Weight | 426.08 g/mol |
| LogP | 4.2384 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 426.08386 |
| Heavy Atoms | 27 |
| Complexity | 889.68353 |
Chemical Identifiers
| CAS Number | 853702-18-8 |
|---|---|
| SMILES | CN(CC1=CC=CS1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3 |
Product Overview
3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide (CAS 853702-18-8), with molecular formula C19H23ClN2O3S2 and molecular weight 426.08 g/mol. IUPAC: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide.
Chemical Property Profile of 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide
Property Insights of 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide
The XLogP value of 4.2384 indicates that 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide has 0 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-methyl-N-(thiophen-2-ylmethyl)benzamide?
The CAS number of 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide is 853702-18-8.
What is the molecular formula of 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide?
The molecular formula of 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide is C19H23ClN2O3S2.
What is the molecular weight of 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide?
The molecular weight of 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide is 426.08 g/mol.
Where can I buy 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide?
You can request a quote for 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-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-methyl-N-(thiophen-2-ylmethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.