N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide
TL;DR: N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide (CAS 321533-72-6) is a chemical compound with molecular formula C16H13ClN4O and molecular weight 312.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chlorophenyl)methyl]-6-pyrazol-1-ylpyridine-3-carboxamide
Also Known As: Bionet2_000320, N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide, N-[(4-chlorophenyl)methyl]-6-pyrazol-1-ylpyridine-3-carboxamide, N-[(4-chlorophenyl)methyl]-6-(1H-pyrazol-1-yl)pyridine-3-carboxamide
| Molecular Formula | C16H13ClN4O |
|---|---|
| Molecular Weight | 312.08 g/mol |
| LogP | 2.8507 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.0778 |
| Heavy Atoms | 22 |
| Complexity | 751.8546 |
Chemical Identifiers
| CAS Number | 321533-72-6 |
|---|---|
| SMILES | C1=CN(N=C1)C2=NC=C(C=C2)C(=O)NCC3=CC=C(C=C3)Cl |
Product Overview
N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide (CAS 321533-72-6), with molecular formula C16H13ClN4O and molecular weight 312.08 g/mol. IUPAC: N-[(4-chlorophenyl)methyl]-6-pyrazol-1-ylpyridine-3-carboxamide.
Chemical Property Profile of N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide
Property Insights of N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide
The XLogP value of 2.8507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide. With a topological polar surface area (TPSA) of 59.81 Ų, N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide 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 N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide?
The CAS number of N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide is 321533-72-6.
What is the molecular formula of N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide?
The molecular formula of N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide is C16H13ClN4O.
What is the molecular weight of N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide?
The molecular weight of N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide is 312.08 g/mol.
Where can I buy N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide?
You can request a quote for N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chlorobenzyl)-6-(1H-pyrazol-1-yl)nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.