N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide
TL;DR: N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide (CAS 535977-08-3) is a chemical compound with molecular formula C13H10ClN3O2 and molecular weight 275.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-carbamoylphenyl)-2-chloropyridine-3-carboxamide
Also Known As: N-(2-Carbamoylphenyl)-2-chloronicotinamide, N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide, N-(2-carbamoylphenyl)-2-chloropyridine-3-carboxamide, 4-METHYLSULFONYLPHENYLACETIC ACID, BAS 06850717
| Molecular Formula | C13H10ClN3O2 |
|---|---|
| Molecular Weight | 275.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 85.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.04614 |
| Heavy Atoms | 19 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 535977-08-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)N)NC(=O)C2=C(N=CC=C2)Cl |
| InChIKey | RNQZTQCLZSVCJN-UHFFFAOYSA-N |
Product Overview
N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide (CAS 535977-08-3), with molecular formula C13H10ClN3O2 and molecular weight 275.05 g/mol. IUPAC: N-(2-carbamoylphenyl)-2-chloropyridine-3-carboxamide.
Chemical Property Profile of N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide
Property Insights of N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide. The TPSA of 85.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide. Following Lipinski's Rule of Five, N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide has 2 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-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide?
The CAS number of N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide is 535977-08-3.
What is the molecular formula of N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide?
The molecular formula of N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide is C13H10ClN3O2.
What is the molecular weight of N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide?
The molecular weight of N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide is 275.05 g/mol.
Where can I buy N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide?
You can request a quote for N-(2-Carbamoyl-phenyl)-2-chloro-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-Carbamoyl-phenyl)-2-chloro-nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Carbamoyl-phenyl)-2-chloro-nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.