![5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide structure](/static/products/887/887693-16-5.png)
5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
TL;DR: 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide (CAS 887693-16-5) is a chemical compound with molecular formula C10H11N5OS and molecular weight 249.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-1-(3-methylsulfanylphenyl)triazole-4-carboxamide
Also Known As: 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide, ASN 13846607, 5-amino-1-(3-methylsulfanylphenyl)triazole-4-carboxamide, 5-Amino-1-(3-(methylthio)phenyl)-1H-1,2,3-triazole-4-carboxamide, 5-Amino-1-(3-methylsulfanyl-phenyl)-1H-[1,2,3]triazole-4-carboxylic acid amide
| Molecular Formula | C10H11N5OS |
|---|---|
| Molecular Weight | 249.07 g/mol |
| LogP | 0.6703 |
| Topological Polar Surface Area | 99.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.06844 |
| Heavy Atoms | 17 |
| Complexity | 565.5739 |
Chemical Identifiers
| CAS Number | 887693-16-5 |
|---|---|
| SMILES | CSC1=CC=CC(=C1)N2C(=C(N=N2)C(=O)N)N |
Product Overview
5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide (CAS 887693-16-5), with molecular formula C10H11N5OS and molecular weight 249.07 g/mol. IUPAC: 5-amino-1-(3-methylsulfanylphenyl)triazole-4-carboxamide.
Chemical Property Profile of 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Property Insights of 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
The XLogP value of 0.6703 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide. The TPSA of 99.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide. Following Lipinski's Rule of Five, 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide 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 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide?
The CAS number of 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide is 887693-16-5.
What is the molecular formula of 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide?
The molecular formula of 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide is C10H11N5OS.
What is the molecular weight of 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide?
The molecular weight of 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide is 249.07 g/mol.
Where can I buy 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide?
You can request a quote for 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-amino-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.