(2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile
TL;DR: (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile (CAS 469872-10-4) is a chemical compound with molecular formula C7H8N4S and molecular weight 180.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile
Also Known As: 3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile, (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile, (E)-3-Amino-2-(2-aminothiazol-4-yl)but-2-enenitrile, (E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile, F3097-2850
| Molecular Formula | C7H8N4S |
|---|---|
| Molecular Weight | 180.05 g/mol |
| LogP | 0.93858 |
| Topological Polar Surface Area | 88.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.04697 |
| Heavy Atoms | 12 |
| Complexity | 353.72842 |
Chemical Identifiers
| CAS Number | 469872-10-4 |
|---|---|
| SMILES | C/C(=C(\C#N)/C1=CSC(=N1)N)/N |
Product Overview
(2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile (CAS 469872-10-4), with molecular formula C7H8N4S and molecular weight 180.05 g/mol. IUPAC: (E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile.
Chemical Property Profile of (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile
Property Insights of (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile
The XLogP value of 0.93858 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile. The TPSA of 88.72 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile. Following Lipinski's Rule of Five, (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile has 2 hydrogen bond donor(s) and 5 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 (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile?
The CAS number of (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile is 469872-10-4.
What is the molecular formula of (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile?
The molecular formula of (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile is C7H8N4S.
What is the molecular weight of (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile?
The molecular weight of (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile is 180.05 g/mol.
Where can I buy (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile?
You can request a quote for (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-amino-2-(2-amino-1,3-thiazol-4-yl)but-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.