Benzotriazole-1-carboxamide
TL;DR: Benzotriazole-1-carboxamide (CAS 5933-29-9) is a chemical compound with molecular formula C7H6N4O and molecular weight 162.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzotriazole-1-carboxamide
Also Known As: Benzotriazole-1-carboxamide, 1H-1,2,3-benzotriazole-1-carboxamide, 1-Carbamoyl-benzotriazol, benzotriazol-1-carboxamide, 1-carbamoyl-1H-benzotriazole
| Molecular Formula | C7H6N4O |
|---|---|
| Molecular Weight | 162.05 g/mol |
| LogP | 0.3581 |
| Topological Polar Surface Area | 73.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 162.05415 |
| Heavy Atoms | 12 |
| Complexity | 433.65393 |
Chemical Identifiers
| CAS Number | 5933-29-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2C(=O)N |
Product Overview
Benzotriazole-1-carboxamide (CAS 5933-29-9), with molecular formula C7H6N4O and molecular weight 162.05 g/mol. IUPAC: benzotriazole-1-carboxamide.
Chemical Property Profile of Benzotriazole-1-carboxamide
Property Insights of Benzotriazole-1-carboxamide
The XLogP value of 0.3581 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzotriazole-1-carboxamide. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzotriazole-1-carboxamide. Following Lipinski's Rule of Five, Benzotriazole-1-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 Benzotriazole-1-carboxamide?
The CAS number of Benzotriazole-1-carboxamide is 5933-29-9.
What is the molecular formula of Benzotriazole-1-carboxamide?
The molecular formula of Benzotriazole-1-carboxamide is C7H6N4O.
What is the molecular weight of Benzotriazole-1-carboxamide?
The molecular weight of Benzotriazole-1-carboxamide is 162.05 g/mol.
Where can I buy Benzotriazole-1-carboxamide?
You can request a quote for Benzotriazole-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzotriazole-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for Benzotriazole-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.