3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide
TL;DR: 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide (CAS 331968-31-1) is a chemical compound with molecular formula C19H13ClN4O and molecular weight 348.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(2-phenylbenzotriazol-5-yl)benzamide
Also Known As: BAS 00705544, 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide, 3-chloro-N-(2-phenylbenzotriazol-5-yl)benzamide, 3-chloro-N-(2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide, 3-Chloro-N-(2-phenyl-2H-benzotriazol-5-yl)-benzamide
| Molecular Formula | C19H13ClN4O |
|---|---|
| Molecular Weight | 348.08 g/mol |
| LogP | 4.3262 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.0778 |
| Heavy Atoms | 25 |
| Complexity | 1059.4178 |
Chemical Identifiers
| CAS Number | 331968-31-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=CC=C4)Cl |
Product Overview
3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide (CAS 331968-31-1), with molecular formula C19H13ClN4O and molecular weight 348.08 g/mol. IUPAC: 3-chloro-N-(2-phenylbenzotriazol-5-yl)benzamide.
Chemical Property Profile of 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide
Property Insights of 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide
The XLogP value of 4.3262 indicates that 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide 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 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide?
The CAS number of 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide is 331968-31-1.
What is the molecular formula of 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide?
The molecular formula of 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide is C19H13ClN4O.
What is the molecular weight of 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide?
The molecular weight of 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide is 348.08 g/mol.
Where can I buy 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide?
You can request a quote for 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-(2-phenyl-2H-benzotriazol-5-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.