![2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone structure](/static/products/3990/39901-94-5.webp)
2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone
TL;DR: 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone (CAS 39901-94-5) is a chemical compound with molecular formula C18H18ClNO and molecular weight 299.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloroanilino)-2-phenylcyclohexan-1-one
Also Known As: 2-[(3-chlorophenyl)amino]-2-phenylcyclohexanone, 2-(3-chloroanilino)-2-phenylcyclohexan-1-one, 2-(3-chloroanilino)-2-phenyl-1-cyclohexanone, 2-[(3-chlorophenyl)amino]-2-phenyl-cyclohexan-1-one
| Molecular Formula | C18H18ClNO |
|---|---|
| Molecular Weight | 299.11 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.1077 |
| Heavy Atoms | 21 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 39901-94-5 |
|---|---|
| SMILES | C1CCC(C(=O)C1)(C2=CC=CC=C2)NC3=CC(=CC=C3)Cl |
| InChIKey | BBTPEIJYJODHJW-UHFFFAOYSA-N |
Product Overview
2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone (CAS 39901-94-5), with molecular formula C18H18ClNO and molecular weight 299.11 g/mol. IUPAC: 2-(3-chloroanilino)-2-phenylcyclohexan-1-one.
Chemical Property Profile of 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone
Property Insights of 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone
The XLogP value of 4.7 indicates that 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone 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-Chlorophenyl)amino]-2-phenylcyclohexanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone 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-Chlorophenyl)amino]-2-phenylcyclohexanone?
The CAS number of 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone is 39901-94-5.
What is the molecular formula of 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone?
The molecular formula of 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone is C18H18ClNO.
What is the molecular weight of 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone?
The molecular weight of 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone is 299.11 g/mol.
Where can I buy 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone?
You can request a quote for 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Chlorophenyl)amino]-2-phenylcyclohexanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.