3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide
TL;DR: 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide (CAS 642430-76-0) is a chemical compound with molecular formula C19H12BrClN4O and molecular weight 425.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-(6-chloro-2-phenylbenzotriazol-5-yl)benzamide
Also Known As: 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide, AP-970/42166193, 3-bromo-N-(6-chloro-2-phenylbenzotriazol-5-yl)benzamide, 3-bromo-N-(6-chloro-2-phenyl-2H-benzotriazol-5-yl)benzamide
| Molecular Formula | C19H12BrClN4O |
|---|---|
| Molecular Weight | 425.99 g/mol |
| LogP | 5.0887 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 425.9883 |
| Heavy Atoms | 26 |
| Complexity | 1111.1903 |
Chemical Identifiers
| CAS Number | 642430-76-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=CC(=CC=C4)Br |
Product Overview
3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide (CAS 642430-76-0), with molecular formula C19H12BrClN4O and molecular weight 425.99 g/mol. IUPAC: 3-bromo-N-(6-chloro-2-phenylbenzotriazol-5-yl)benzamide.
Chemical Property Profile of 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide
Property Insights of 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide
The XLogP value of 5.0887 indicates that 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-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-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide?
The CAS number of 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide is 642430-76-0.
What is the molecular formula of 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide?
The molecular formula of 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide is C19H12BrClN4O.
What is the molecular weight of 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide?
The molecular weight of 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide is 425.99 g/mol.
Where can I buy 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide?
You can request a quote for 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-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-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.