N-(2-chloro-4,6-dimethylphenyl)nicotinamide
TL;DR: N-(2-chloro-4,6-dimethylphenyl)nicotinamide (CAS 449170-06-3) is a chemical compound with molecular formula C14H13ClN2O and molecular weight 260.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloro-4,6-dimethylphenyl)pyridine-3-carboxamide
Also Known As: N-(2-chloro-4,6-dimethylphenyl)nicotinamide, BAS 04806778, N-(2-chloro-4,6-xylyl)nicotinamide, N-(2-chloro-4,6-dimethylphenyl)pyridine-3-carboxamide, N-(2-Chloro-4,6-dimethyl-phenyl)-nicotinamide
| Molecular Formula | C14H13ClN2O |
|---|---|
| Molecular Weight | 260.07 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.07166 |
| Heavy Atoms | 18 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 449170-06-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)Cl)NC(=O)C2=CN=CC=C2)C |
| InChIKey | ZBIGAGUOUCZMSM-UHFFFAOYSA-N |
Product Overview
N-(2-chloro-4,6-dimethylphenyl)nicotinamide (CAS 449170-06-3), with molecular formula C14H13ClN2O and molecular weight 260.07 g/mol. IUPAC: N-(2-chloro-4,6-dimethylphenyl)pyridine-3-carboxamide.
Chemical Property Profile of N-(2-chloro-4,6-dimethylphenyl)nicotinamide
Property Insights of N-(2-chloro-4,6-dimethylphenyl)nicotinamide
The XLogP value of 3.0 indicates that N-(2-chloro-4,6-dimethylphenyl)nicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, N-(2-chloro-4,6-dimethylphenyl)nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-chloro-4,6-dimethylphenyl)nicotinamide has 1 hydrogen bond donor(s) and 2 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-(2-chloro-4,6-dimethylphenyl)nicotinamide?
The CAS number of N-(2-chloro-4,6-dimethylphenyl)nicotinamide is 449170-06-3.
What is the molecular formula of N-(2-chloro-4,6-dimethylphenyl)nicotinamide?
The molecular formula of N-(2-chloro-4,6-dimethylphenyl)nicotinamide is C14H13ClN2O.
What is the molecular weight of N-(2-chloro-4,6-dimethylphenyl)nicotinamide?
The molecular weight of N-(2-chloro-4,6-dimethylphenyl)nicotinamide is 260.07 g/mol.
Where can I buy N-(2-chloro-4,6-dimethylphenyl)nicotinamide?
You can request a quote for N-(2-chloro-4,6-dimethylphenyl)nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-chloro-4,6-dimethylphenyl)nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chloro-4,6-dimethylphenyl)nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.