3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile
TL;DR: 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile (CAS 32083-31-1) is a chemical compound with molecular formula C9H7ClN2O2S and molecular weight 241.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile
Also Known As: Maybridge1_004631, BAS 00100514, 3-amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile, 3-amino-2-[(4-chlorophenyl)sulfonyl]acrylonitrile, 2-Propenenitrile,3-amino-2-[(4-chlorophenyl)sulfonyl]-
| Molecular Formula | C9H7ClN2O2S |
|---|---|
| Molecular Weight | 241.99 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.99167 |
| Heavy Atoms | 15 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 32083-31-1 |
|---|---|
| SMILES | C1=CC(=CC=C1S(=O)(=O)C(=CN)C#N)Cl |
| InChIKey | BOTZBEHWOJJLSC-UHFFFAOYSA-N |
Product Overview
3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile (CAS 32083-31-1), with molecular formula C9H7ClN2O2S and molecular weight 241.99 g/mol. IUPAC: 3-amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile.
Chemical Property Profile of 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile
Property Insights of 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile. Following Lipinski's Rule of Five, 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile 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-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile?
The CAS number of 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile is 32083-31-1.
What is the molecular formula of 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile?
The molecular formula of 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile is C9H7ClN2O2S.
What is the molecular weight of 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile?
The molecular weight of 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile is 241.99 g/mol.
Where can I buy 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile?
You can request a quote for 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.