N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide
TL;DR: N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide (CAS 449170-41-6) is a chemical compound with molecular formula C14H13ClN2O2 and molecular weight 276.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide
Also Known As: N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide, BAS 04806815, AP-906/41251857, N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide, N-(4-Chloro-2-methoxy-5-methyl-phenyl)-isonicotinamide
| Molecular Formula | C14H13ClN2O2 |
|---|---|
| Molecular Weight | 276.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.06656 |
| Heavy Atoms | 19 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 449170-41-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC=NC=C2 |
| InChIKey | ZBYYAAFYRNPRNV-UHFFFAOYSA-N |
Product Overview
N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide (CAS 449170-41-6), with molecular formula C14H13ClN2O2 and molecular weight 276.07 g/mol. IUPAC: N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-4-carboxamide.
Chemical Property Profile of N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide
Property Insights of N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide. With a topological polar surface area (TPSA) of 51.2 Ų, N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide 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-chloro-2-methoxy-5-methylphenyl)isonicotinamide?
The CAS number of N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide is 449170-41-6.
What is the molecular formula of N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide?
The molecular formula of N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide is C14H13ClN2O2.
What is the molecular weight of N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide?
The molecular weight of N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide is 276.07 g/mol.
Where can I buy N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide?
You can request a quote for N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chloro-2-methoxy-5-methylphenyl)isonicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.