3-(2-Amino-1,3-thiazol-4-yl)benzonitrile
TL;DR: 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile (CAS 202664-32-2) is a chemical compound with molecular formula C10H7N3S and molecular weight 201.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-amino-1,3-thiazol-4-yl)benzonitrile
Also Known As: 3-(2-amino-1,3-thiazol-4-yl)benzonitrile, 3-(2-Aminothiazol-4-yl)benzonitrile, 3-(2-amino-thiazol-4-yl)-benzonitrile, 3-(2-amino-4-thiazolyl)Benzonitrile, Benzonitrile, 3-(2-amino-4-thiazolyl)-
| Molecular Formula | C10H7N3S |
|---|---|
| Molecular Weight | 201.04 g/mol |
| LogP | 2.26398 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.03607 |
| Heavy Atoms | 14 |
| Complexity | 496.0634 |
Chemical Identifiers
| CAS Number | 202664-32-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C2=CSC(=N2)N)C#N |
Product Overview
3-(2-Amino-1,3-thiazol-4-yl)benzonitrile (CAS 202664-32-2), with molecular formula C10H7N3S and molecular weight 201.04 g/mol. IUPAC: 3-(2-amino-1,3-thiazol-4-yl)benzonitrile.
Chemical Property Profile of 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile
Property Insights of 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile
The XLogP value of 2.26398 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile. Following Lipinski's Rule of Five, 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile 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-(2-Amino-1,3-thiazol-4-yl)benzonitrile?
The CAS number of 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile is 202664-32-2.
What is the molecular formula of 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile?
The molecular formula of 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile is C10H7N3S.
What is the molecular weight of 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile?
The molecular weight of 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile is 201.04 g/mol.
Where can I buy 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile?
You can request a quote for 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Amino-1,3-thiazol-4-yl)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.