2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide
TL;DR: 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide (CAS 148122-85-4) is a chemical compound with molecular formula C14H14ClN3O and molecular weight 275.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloroanilino)-4,6-dimethylpyridine-3-carboxamide
Also Known As: BAS 00990053, BIM-0015393.P001, 2-(3-chloroanilino)-4,6-dimethylnicotinamide, 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide, 2-(3-chloroanilino)-4,6-dimethylpyridine-3-carboxamide
| Molecular Formula | C14H14ClN3O |
|---|---|
| Molecular Weight | 275.08 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 68.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.08255 |
| Heavy Atoms | 19 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 148122-85-4 |
|---|---|
| SMILES | CC1=CC(=NC(=C1C(=O)N)NC2=CC(=CC=C2)Cl)C |
| InChIKey | HXGRENUTXXGSAX-UHFFFAOYSA-N |
Product Overview
2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide (CAS 148122-85-4), with molecular formula C14H14ClN3O and molecular weight 275.08 g/mol. IUPAC: 2-(3-chloroanilino)-4,6-dimethylpyridine-3-carboxamide.
Chemical Property Profile of 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide
Property Insights of 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide
The XLogP value of 3.5 indicates that 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide. Following Lipinski's Rule of Five, 2-(3-Chloro-phenylamino)-4,6-dimethyl-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 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide?
The CAS number of 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide is 148122-85-4.
What is the molecular formula of 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide?
The molecular formula of 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide is C14H14ClN3O.
What is the molecular weight of 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide?
The molecular weight of 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide is 275.08 g/mol.
Where can I buy 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide?
You can request a quote for 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Chloro-phenylamino)-4,6-dimethyl-nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.