1-phenyl-1H-1,2,3-triazole-4-carboxamide
TL;DR: 1-phenyl-1H-1,2,3-triazole-4-carboxamide (CAS 2055-53-0) is a chemical compound with molecular formula C9H8N4O and molecular weight 188.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyltriazole-4-carboxamide
Also Known As: 1-phenyltriazole-4-carboxamide, 1-phenyl-1H-1,2,3-triazole-4-carboxamide, 1-Phenyl-4-carboxamid-1,2,3-triazol, 1-phenyl-1,2,3-triazole-4-carboxamide, J3.582.603C
| Molecular Formula | C9H8N4O |
|---|---|
| Molecular Weight | 188.07 g/mol |
| LogP | 0.3662 |
| Topological Polar Surface Area | 73.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.06981 |
| Heavy Atoms | 14 |
| Complexity | 448.84534 |
Chemical Identifiers
| CAS Number | 2055-53-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=C(N=N2)C(=O)N |
Product Overview
1-phenyl-1H-1,2,3-triazole-4-carboxamide (CAS 2055-53-0), with molecular formula C9H8N4O and molecular weight 188.07 g/mol. IUPAC: 1-phenyltriazole-4-carboxamide.
Chemical Property Profile of 1-phenyl-1H-1,2,3-triazole-4-carboxamide
Property Insights of 1-phenyl-1H-1,2,3-triazole-4-carboxamide
The XLogP value of 0.3662 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-phenyl-1H-1,2,3-triazole-4-carboxamide. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-phenyl-1H-1,2,3-triazole-4-carboxamide. Following Lipinski's Rule of Five, 1-phenyl-1H-1,2,3-triazole-4-carboxamide has 1 hydrogen bond donor(s) and 3 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 1-phenyl-1H-1,2,3-triazole-4-carboxamide?
The CAS number of 1-phenyl-1H-1,2,3-triazole-4-carboxamide is 2055-53-0.
What is the molecular formula of 1-phenyl-1H-1,2,3-triazole-4-carboxamide?
The molecular formula of 1-phenyl-1H-1,2,3-triazole-4-carboxamide is C9H8N4O.
What is the molecular weight of 1-phenyl-1H-1,2,3-triazole-4-carboxamide?
The molecular weight of 1-phenyl-1H-1,2,3-triazole-4-carboxamide is 188.07 g/mol.
Where can I buy 1-phenyl-1H-1,2,3-triazole-4-carboxamide?
You can request a quote for 1-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 1-phenyl-1H-1,2,3-triazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-phenyl-1H-1,2,3-triazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.