3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone
TL;DR: 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone (CAS 477334-05-7) is a chemical compound with molecular formula C17H18ClNO and molecular weight 287.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chloro-4-methylanilino)-1-(4-methylphenyl)propan-1-one
Also Known As: 3-((3-Chloro-4-methylphenyl)amino)-1-(p-tolyl)propan-1-one, 3-(3-chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone, 3-(3-chloro-4-methylanilino)-1-(4-methylphenyl)propan-1-one, 3-(3-chloro-4-methyl-anilino)-1-(p-tolyl)propan-1-one, 3-[(3-chloro-4-methylphenyl)amino]-1-(4-methylphenyl)propan-1-one
| Molecular Formula | C17H18ClNO |
|---|---|
| Molecular Weight | 287.11 g/mol |
| LogP | 4.64174 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 287.1077 |
| Heavy Atoms | 20 |
| Complexity | 604.8871 |
Chemical Identifiers
| CAS Number | 477334-05-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)CCNC2=CC(=C(C=C2)C)Cl |
Product Overview
3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone (CAS 477334-05-7), with molecular formula C17H18ClNO and molecular weight 287.11 g/mol. IUPAC: 3-(3-chloro-4-methylanilino)-1-(4-methylphenyl)propan-1-one.
Chemical Property Profile of 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone
Property Insights of 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone
The XLogP value of 4.64174 indicates that 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone 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 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone?
The CAS number of 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone is 477334-05-7.
What is the molecular formula of 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone?
The molecular formula of 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone is C17H18ClNO.
What is the molecular weight of 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone?
The molecular weight of 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone is 287.11 g/mol.
Where can I buy 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone?
You can request a quote for 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Chloro-4-methylanilino)-1-(4-methylphenyl)-1-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.