N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide
TL;DR: N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide (CAS 142312-67-2) is a chemical compound with molecular formula C14H11N5O3 and molecular weight 297.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylbenzotriazol-5-yl)-4-nitrobenzamide
Also Known As: 2-Methyl-5-(4-nitrobenzoyl)amino-2H-benzotriazole, N-(2-methylbenzotriazol-5-yl)-4-nitrobenzamide, N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide, 4-Nitro-N-(2-methyl-2H-benzotriazole-5-yl)benzamide, N-(2-methyl-2H-1,2,3-benzotriazol-5-yl)-4-nitrobenzamide
| Molecular Formula | C14H11N5O3 |
|---|---|
| Molecular Weight | 297.09 g/mol |
| LogP | 2.1288 |
| Topological Polar Surface Area | 102.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.08618 |
| Heavy Atoms | 22 |
| Complexity | 869.8206 |
Chemical Identifiers
| CAS Number | 142312-67-2 |
|---|---|
| SMILES | CN1N=C2C=CC(=CC2=N1)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide (CAS 142312-67-2), with molecular formula C14H11N5O3 and molecular weight 297.09 g/mol. IUPAC: N-(2-methylbenzotriazol-5-yl)-4-nitrobenzamide.
Chemical Property Profile of N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide
Property Insights of N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide
The XLogP value of 2.1288 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide. The TPSA of 102.95 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide. Following Lipinski's Rule of Five, N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide has 1 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 N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide?
The CAS number of N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide is 142312-67-2.
What is the molecular formula of N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide?
The molecular formula of N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide is C14H11N5O3.
What is the molecular weight of N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide?
The molecular weight of N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide is 297.09 g/mol.
Where can I buy N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide?
You can request a quote for N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-methylbenzotriazol-5-yl)-4-nitro-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.