N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide
TL;DR: N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide (CAS 757943-64-9) is a chemical compound with molecular formula C14H11ClN4O and molecular weight 286.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chlorophenyl)-1-methylbenzotriazole-5-carboxamide
Also Known As: BAS 07216739, N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide, N-(2-chlorophenyl)-1-methylbenzotriazole-5-carboxamide, 1-Methyl-1H-benzotriazole-5-carboxylic acid (2-chloro-phenyl)-amide, N-(2-chlorophenyl)-1-methyl-1H-1,2,3-benzotriazole-5-carboxamide
| Molecular Formula | C14H11ClN4O |
|---|---|
| Molecular Weight | 286.06 g/mol |
| LogP | 2.874 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.06213 |
| Heavy Atoms | 20 |
| Complexity | 796.72314 |
Chemical Identifiers
| CAS Number | 757943-64-9 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3Cl)N=N1 |
Product Overview
N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide (CAS 757943-64-9), with molecular formula C14H11ClN4O and molecular weight 286.06 g/mol. IUPAC: N-(2-chlorophenyl)-1-methylbenzotriazole-5-carboxamide.
Chemical Property Profile of N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide
Property Insights of N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide
The XLogP value of 2.874 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide. With a topological polar surface area (TPSA) of 59.81 Ų, N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-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 N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide?
The CAS number of N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide is 757943-64-9.
What is the molecular formula of N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide?
The molecular formula of N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide is C14H11ClN4O.
What is the molecular weight of N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide?
The molecular weight of N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide is 286.06 g/mol.
Where can I buy N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide?
You can request a quote for N-(2-chlorophenyl)-1-methyl-1H-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-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chlorophenyl)-1-methyl-1H-benzotriazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.