2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone
TL;DR: 2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone (CAS 333306-66-4) is a chemical compound with molecular formula C16H16ClNO and molecular weight 273.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloro-4-methylanilino)-1-(4-methylphenyl)ethanone
Also Known As: BAS 02079203, 2-(3-chloro-4-methylanilino)-1-(4-methylphenyl)ethanone, 2-(3-Chloro-4-methyl-phenylamino)-1-p-tolyl-ethanone, 2-(3-chloro-4-methyl-anilino)-1-(p-tolyl)ethanone, 2-[(3-chloro-4-methylphenyl)amino]-1-(4-methylphenyl)ethanone
| Molecular Formula | C16H16ClNO |
|---|---|
| Molecular Weight | 273.09 g/mol |
| LogP | 4.25164 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 273.09204 |
| Heavy Atoms | 19 |
| Complexity | 590.198 |
Chemical Identifiers
| CAS Number | 333306-66-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)CNC2=CC(=C(C=C2)C)Cl |
Product Overview
2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone (CAS 333306-66-4), with molecular formula C16H16ClNO and molecular weight 273.09 g/mol. IUPAC: 2-(3-chloro-4-methylanilino)-1-(4-methylphenyl)ethanone.
Chemical Property Profile of 2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone
Property Insights of 2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone
The XLogP value of 4.25164 indicates that 2-(3-Chloro-4-methylanilino)-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-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Chloro-4-methylanilino)-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-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone?
The CAS number of 2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone is 333306-66-4.
What is the molecular formula of 2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone?
The molecular formula of 2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone is C16H16ClNO.
What is the molecular weight of 2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone?
The molecular weight of 2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone is 273.09 g/mol.
Where can I buy 2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone?
You can request a quote for 2-(3-Chloro-4-methylanilino)-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-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.