![1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione structure](/static/products/499/499197-69-2.png)
1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione
TL;DR: 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione (CAS 499197-69-2) is a chemical compound with molecular formula C17H10ClN3O2 and molecular weight 323.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-chlorophenyl)methyl]benzo[f]benzotriazole-4,9-dione
Also Known As: J3.469.901A, AP-006/41010213, 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione, 3-[(3-chlorophenyl)methyl]benzo[f]benzotriazole-4,9-dione, 1-(3-Chlorobenzyl)-1H-naphtho[2,3-d]triazole-4,9-dione
| Molecular Formula | C17H10ClN3O2 |
|---|---|
| Molecular Weight | 323.05 g/mol |
| LogP | 2.7552 |
| Topological Polar Surface Area | 64.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 323.04614 |
| Heavy Atoms | 23 |
| Complexity | 961.97723 |
Chemical Identifiers
| CAS Number | 499197-69-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)N(N=N3)CC4=CC(=CC=C4)Cl |
Product Overview
1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione (CAS 499197-69-2), with molecular formula C17H10ClN3O2 and molecular weight 323.05 g/mol. IUPAC: 3-[(3-chlorophenyl)methyl]benzo[f]benzotriazole-4,9-dione.
Chemical Property Profile of 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione
Property Insights of 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione
The XLogP value of 2.7552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione. The TPSA of 64.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione. Following Lipinski's Rule of Five, 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione has 0 hydrogen bond donor(s) and 4 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 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione?
The CAS number of 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione is 499197-69-2.
What is the molecular formula of 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione?
The molecular formula of 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione is C17H10ClN3O2.
What is the molecular weight of 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione?
The molecular weight of 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione is 323.05 g/mol.
Where can I buy 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione?
You can request a quote for 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-chlorobenzyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.