2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone
TL;DR: 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone (CAS 333306-63-1) is a chemical compound with molecular formula C15H14ClNO and molecular weight 259.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloroanilino)-1-(4-methylphenyl)ethanone
Also Known As: 2-(3-chloroanilino)-1-(4-methylphenyl)ethanone, BAS 02079192, 2-(3-Chloro-phenylamino)-1-p-tolyl-ethanone, 2-(3-chloroanilino)-1-(p-tolyl)ethanone, 2-[(3-chlorophenyl)amino]-1-(4-methylphenyl)ethanone
| Molecular Formula | C15H14ClNO |
|---|---|
| Molecular Weight | 259.08 g/mol |
| LogP | 3.94322 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.0764 |
| Heavy Atoms | 18 |
| Complexity | 548.675 |
Chemical Identifiers
| CAS Number | 333306-63-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)CNC2=CC(=CC=C2)Cl |
Product Overview
2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone (CAS 333306-63-1), with molecular formula C15H14ClNO and molecular weight 259.08 g/mol. IUPAC: 2-(3-chloroanilino)-1-(4-methylphenyl)ethanone.
Chemical Property Profile of 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone
Property Insights of 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone
The XLogP value of 3.94322 indicates that 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone 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 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone?
The CAS number of 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone is 333306-63-1.
What is the molecular formula of 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone?
The molecular formula of 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone is C15H14ClNO.
What is the molecular weight of 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone?
The molecular weight of 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone is 259.08 g/mol.
Where can I buy 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone?
You can request a quote for 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Chloroanilino)-1-(4-methylphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.