(Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile
TL;DR: (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile (CAS 68342-51-8) is a chemical compound with molecular formula C9H8N2O2S and molecular weight 208.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile
Also Known As: (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile, 3-amino-2-(benzenesulfonyl)prop-2-enenitrile, (2Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile, (2Z)-3-amino-2-(phenylsulfonyl)prop-2-enenitrile
| Molecular Formula | C9H8N2O2S |
|---|---|
| Molecular Weight | 208.03 g/mol |
| LogP | 0.78398 |
| Topological Polar Surface Area | 83.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.03065 |
| Heavy Atoms | 14 |
| Complexity | 483.29327 |
Chemical Identifiers
| CAS Number | 68342-51-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)/C(=C\N)/C#N |
Product Overview
(Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile (CAS 68342-51-8), with molecular formula C9H8N2O2S and molecular weight 208.03 g/mol. IUPAC: (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile.
Chemical Property Profile of (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile
Property Insights of (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile
The XLogP value of 0.78398 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile. The TPSA of 83.95 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile. Following Lipinski's Rule of Five, (Z)-3-amino-2-(benzenesulfonyl)prop-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 (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile?
The CAS number of (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile is 68342-51-8.
What is the molecular formula of (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile?
The molecular formula of (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile is C9H8N2O2S.
What is the molecular weight of (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile?
The molecular weight of (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile is 208.03 g/mol.
Where can I buy (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile?
You can request a quote for (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-amino-2-(benzenesulfonyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.