N-(4-Chlorophenyl)isonicotinamide
TL;DR: N-(4-Chlorophenyl)isonicotinamide (CAS 14547-69-4) is a chemical compound with molecular formula C12H9ClN2O and molecular weight 232.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)pyridine-4-carboxamide
Also Known As: N-(4-Chlorophenyl)isonicotinamide, N-(4-chlorophenyl)pyridine-4-carboxamide, 4-Pyridinecarboxamide, N-(4-chlorophenyl)-, N-(4-Chloro-phenyl)-isonicotinamide, N-[p-Chlorophenyl]isonicotinamide
| Molecular Formula | C12H9ClN2O |
|---|---|
| Molecular Weight | 232.04 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.04034 |
| Heavy Atoms | 16 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 14547-69-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)C2=CC=NC=C2)Cl |
| InChIKey | QXVSZZRIGDEOOB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(4-Chlorophenyl)isonicotinamide (CAS 14547-69-4), with molecular formula C12H9ClN2O and molecular weight 232.04 g/mol. IUPAC: N-(4-chlorophenyl)pyridine-4-carboxamide.
Chemical Property Profile of N-(4-Chlorophenyl)isonicotinamide
Property Insights of N-(4-Chlorophenyl)isonicotinamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Chlorophenyl)isonicotinamide. With a topological polar surface area (TPSA) of 42.0 Ų, N-(4-Chlorophenyl)isonicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-Chlorophenyl)isonicotinamide 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-(4-Chlorophenyl)isonicotinamide?
The CAS number of N-(4-Chlorophenyl)isonicotinamide is 14547-69-4.
What is the molecular formula of N-(4-Chlorophenyl)isonicotinamide?
The molecular formula of N-(4-Chlorophenyl)isonicotinamide is C12H9ClN2O.
What is the molecular weight of N-(4-Chlorophenyl)isonicotinamide?
The molecular weight of N-(4-Chlorophenyl)isonicotinamide is 232.04 g/mol.
Where can I buy N-(4-Chlorophenyl)isonicotinamide?
You can request a quote for N-(4-Chlorophenyl)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-Chlorophenyl)isonicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Chlorophenyl)isonicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.