3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one
TL;DR: 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one (CAS 332861-75-3) is a chemical compound with molecular formula C20H19Cl2NO3 and molecular weight 391.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,5-dichloroanilino)-5-(3,4-dimethoxyphenyl)cyclohex-2-en-1-one
Also Known As: BAS 01849655, 3-(3,5-dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one, 3-[(3,5-dichlorophenyl)amino]-5-(3,4-dimethoxyphenyl)cyclohex-2-en-1-one, 3-(3,5-dichloroanilino)-5-(3,4-dimethoxyphenyl)cyclohex-2-en-1-one, 3-(3,5-Dichloro-phenylamino)-5-(3,4-dimethoxy-phenyl)-cyclohex-2-enone
| Molecular Formula | C20H19Cl2NO3 |
|---|---|
| Molecular Weight | 391.07 g/mol |
| LogP | 5.4531 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.0742 |
| Heavy Atoms | 26 |
| Complexity | 843.87994 |
Chemical Identifiers
| CAS Number | 332861-75-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2CC(=CC(=O)C2)NC3=CC(=CC(=C3)Cl)Cl)OC |
Product Overview
3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one (CAS 332861-75-3), with molecular formula C20H19Cl2NO3 and molecular weight 391.07 g/mol. IUPAC: 3-(3,5-dichloroanilino)-5-(3,4-dimethoxyphenyl)cyclohex-2-en-1-one.
Chemical Property Profile of 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one
Property Insights of 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one
The XLogP value of 5.4531 indicates that 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one?
The CAS number of 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one is 332861-75-3.
What is the molecular formula of 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one?
The molecular formula of 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one is C20H19Cl2NO3.
What is the molecular weight of 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one?
The molecular weight of 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one is 391.07 g/mol.
Where can I buy 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one?
You can request a quote for 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,5-Dichloroanilino)-5-(3,4-dimethoxyphenyl)-2-cyclohexen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.