4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide
TL;DR: 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide (CAS 397280-33-0) is a chemical compound with molecular formula C20H21N3O3S and molecular weight 383.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide
Also Known As: 4-(azepane-1-sulfonyl)-N-(2-cyanophenyl)benzamide, 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide, F0806-0814
| Molecular Formula | C20H21N3O3S |
|---|---|
| Molecular Weight | 383.13 g/mol |
| LogP | 3.37528 |
| Topological Polar Surface Area | 90.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.13037 |
| Heavy Atoms | 27 |
| Complexity | 954.7116 |
Chemical Identifiers
| CAS Number | 397280-33-0 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C#N |
Product Overview
4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide (CAS 397280-33-0), with molecular formula C20H21N3O3S and molecular weight 383.13 g/mol. IUPAC: 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide.
Chemical Property Profile of 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide
Property Insights of 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide
The XLogP value of 3.37528 indicates that 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide. Following Lipinski's Rule of Five, 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)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 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide?
The CAS number of 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide is 397280-33-0.
What is the molecular formula of 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide?
The molecular formula of 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide is C20H21N3O3S.
What is the molecular weight of 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide?
The molecular weight of 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide is 383.13 g/mol.
Where can I buy 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide?
You can request a quote for 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(azepan-1-ylsulfonyl)-N-(2-cyanophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.