N-ethyl-2H-benzotriazole-5-carboxamide
TL;DR: N-ethyl-2H-benzotriazole-5-carboxamide (CAS 300680-29-9) is a chemical compound with molecular formula C9H10N4O and molecular weight 190.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-2H-benzotriazole-5-carboxamide
Also Known As: N-ethyl-2H-benzotriazole-5-carboxamide, 1H-Benzotriazole-6-carboxamide, N-ethyl-
| Molecular Formula | C9H10N4O |
|---|---|
| Molecular Weight | 190.09 g/mol |
| LogP | 0.7076 |
| Topological Polar Surface Area | 70.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 190.08546 |
| Heavy Atoms | 14 |
| Complexity | 462.53482 |
Chemical Identifiers
| CAS Number | 300680-29-9 |
|---|---|
| SMILES | CCNC(=O)C1=CC2=NNN=C2C=C1 |
Product Overview
N-ethyl-2H-benzotriazole-5-carboxamide (CAS 300680-29-9), with molecular formula C9H10N4O and molecular weight 190.09 g/mol. IUPAC: N-ethyl-2H-benzotriazole-5-carboxamide.
Chemical Property Profile of N-ethyl-2H-benzotriazole-5-carboxamide
Property Insights of N-ethyl-2H-benzotriazole-5-carboxamide
The XLogP value of 0.7076 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-ethyl-2H-benzotriazole-5-carboxamide. The TPSA of 70.67 Ų falls within the moderate polarity range, balancing permeability and solubility for N-ethyl-2H-benzotriazole-5-carboxamide. Following Lipinski's Rule of Five, N-ethyl-2H-benzotriazole-5-carboxamide has 2 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 N-ethyl-2H-benzotriazole-5-carboxamide?
The CAS number of N-ethyl-2H-benzotriazole-5-carboxamide is 300680-29-9.
What is the molecular formula of N-ethyl-2H-benzotriazole-5-carboxamide?
The molecular formula of N-ethyl-2H-benzotriazole-5-carboxamide is C9H10N4O.
What is the molecular weight of N-ethyl-2H-benzotriazole-5-carboxamide?
The molecular weight of N-ethyl-2H-benzotriazole-5-carboxamide is 190.09 g/mol.
Where can I buy N-ethyl-2H-benzotriazole-5-carboxamide?
You can request a quote for N-ethyl-2H-benzotriazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-ethyl-2H-benzotriazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-ethyl-2H-benzotriazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.