N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide
TL;DR: N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide (CAS 642431-25-2) is a chemical compound with molecular formula C18H12ClN5O and molecular weight 349.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide
Also Known As: BAS 06856112, AP-970/42166207, N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide, N-(6-Chloro-2-phenyl-2H-benzotriazol-5-yl)-nicotinamide, N-(6-chloro-2-phenyl-2H-benzotriazol-5-yl)pyridine-3-carboxamide
| Molecular Formula | C18H12ClN5O |
|---|---|
| Molecular Weight | 349.07 g/mol |
| LogP | 3.7212 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 349.07303 |
| Heavy Atoms | 25 |
| Complexity | 1047.2101 |
Chemical Identifiers
| CAS Number | 642431-25-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=CN=CC=C4 |
Product Overview
N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide (CAS 642431-25-2), with molecular formula C18H12ClN5O and molecular weight 349.07 g/mol. IUPAC: N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide.
Chemical Property Profile of N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide
Property Insights of N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide
The XLogP value of 3.7212 indicates that N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide. Following Lipinski's Rule of Five, N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide has 1 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 N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide?
The CAS number of N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide is 642431-25-2.
What is the molecular formula of N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide?
The molecular formula of N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide is C18H12ClN5O.
What is the molecular weight of N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide?
The molecular weight of N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide is 349.07 g/mol.
Where can I buy N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide?
You can request a quote for N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-chloro-2-phenylbenzotriazol-5-yl)pyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.