2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide
TL;DR: 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide (CAS 347337-94-4) is a chemical compound with molecular formula C20H14ClN5O3 and molecular weight 407.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide
Also Known As: AB00105088-01, 2-chloro-N-(6-methyl-2-phenyl-2H-benzotriazol-5-yl)-4-nitrobenzamide, 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide, 2-chloro-N-(6-methyl-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-4-nitrobenzamide
| Molecular Formula | C20H14ClN5O3 |
|---|---|
| Molecular Weight | 407.08 g/mol |
| LogP | 4.54282 |
| Topological Polar Surface Area | 102.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.07852 |
| Heavy Atoms | 29 |
| Complexity | 1253.9541 |
Chemical Identifiers
| CAS Number | 347337-94-4 |
|---|---|
| SMILES | CC1=CC2=NN(N=C2C=C1NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C4=CC=CC=C4 |
Product Overview
2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide (CAS 347337-94-4), with molecular formula C20H14ClN5O3 and molecular weight 407.08 g/mol. IUPAC: 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide.
Chemical Property Profile of 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide
Property Insights of 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide
The XLogP value of 4.54282 indicates that 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide. Following Lipinski's Rule of Five, 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide 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 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide?
The CAS number of 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide is 347337-94-4.
What is the molecular formula of 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide?
The molecular formula of 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide is C20H14ClN5O3.
What is the molecular weight of 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide?
The molecular weight of 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide is 407.08 g/mol.
Where can I buy 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide?
You can request a quote for 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.