N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide
TL;DR: N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide (CAS 164299-71-2) is a chemical compound with molecular formula C13H11N5O and molecular weight 253.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide
Also Known As: N-Benzotriazol-1-ylmethyl-nicotinamide, N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide, J1.212.350G, N-[(1H-Benzotriazole-1-yl)methyl]pyridine-3-carboxamide, N-[(1H-1,2,3-benzotriazol-1-yl)methyl]pyridine-3-carboxamide
| Molecular Formula | C13H11N5O |
|---|---|
| Molecular Weight | 253.10 g/mol |
| LogP | 1.2138 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.09636 |
| Heavy Atoms | 19 |
| Complexity | 707.14014 |
Chemical Identifiers
| CAS Number | 164299-71-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2CNC(=O)C3=CN=CC=C3 |
Product Overview
N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide (CAS 164299-71-2), with molecular formula C13H11N5O and molecular weight 253.10 g/mol. IUPAC: N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide.
Chemical Property Profile of N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide
Property Insights of N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide
The XLogP value of 1.2138 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide. Following Lipinski's Rule of Five, N-(benzotriazol-1-ylmethyl)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-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide?
The CAS number of N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide is 164299-71-2.
What is the molecular formula of N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide?
The molecular formula of N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide is C13H11N5O.
What is the molecular weight of N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide?
The molecular weight of N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide is 253.10 g/mol.
Where can I buy N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide?
You can request a quote for N-(benzotriazol-1-ylmethyl)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-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(benzotriazol-1-ylmethyl)pyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.