2-Amino-1,3-thiazole-4-carbonitrile 3-oxide
TL;DR: 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide (CAS 351073-95-5) is a chemical compound with molecular formula C4H3N3OS and molecular weight 141.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2-imino-1,3-thiazole-4-carbonitrile
Also Known As: 2-Amino-4-cyanothiazole 3-oxide, 2-amino-1,3-thiazole-4-carbonitrile 3-oxide, 3-hydroxy-2-imino-1,3-thiazole-4-carbonitrile, 2-amino-3-hydroxy-1,3-thiazole-4-carbonitrile
| Molecular Formula | C4H3N3OS |
|---|---|
| Molecular Weight | 141.00 g/mol |
| LogP | 0.13805 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.99968 |
| Heavy Atoms | 9 |
| Complexity | 304.34802 |
Chemical Identifiers
| CAS Number | 351073-95-5 |
|---|---|
| SMILES | C1=C(N(C(=N)S1)O)C#N |
Product Overview
2-Amino-1,3-thiazole-4-carbonitrile 3-oxide (CAS 351073-95-5), with molecular formula C4H3N3OS and molecular weight 141.00 g/mol. IUPAC: 3-hydroxy-2-imino-1,3-thiazole-4-carbonitrile.
Chemical Property Profile of 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide
Property Insights of 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide
The XLogP value of 0.13805 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide. Following Lipinski's Rule of Five, 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide has 2 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 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide?
The CAS number of 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide is 351073-95-5.
What is the molecular formula of 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide?
The molecular formula of 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide is C4H3N3OS.
What is the molecular weight of 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide?
The molecular weight of 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide is 141.00 g/mol.
Where can I buy 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide?
You can request a quote for 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-1,3-thiazole-4-carbonitrile 3-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.