3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one
TL;DR: 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one (CAS 312501-01-2) is a chemical compound with molecular formula C20H21NO3 and molecular weight 323.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dimethoxyanilino)-5-phenylcyclohex-2-en-1-one
Also Known As: 3-(2,4-dimethoxyanilino)-5-phenylcyclohex-2-en-1-one, 3-[(2,4-dimethoxyphenyl)amino]-5-phenylcyclohex-2-en-1-one, 3-[(2,4-dimethoxyphenyl)amino]-5-phenyl-2-cyclohexen-1-one, 5-((2,4-Dimethoxyphenyl)amino)-1,6-dihydro-[1,1'-biphenyl]-3(2H)-one, N/A
| Molecular Formula | C20H21NO3 |
|---|---|
| Molecular Weight | 323.15 g/mol |
| LogP | 4.1463 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.15213 |
| Heavy Atoms | 24 |
| Complexity | 752.7342 |
Chemical Identifiers
| CAS Number | 312501-01-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NC2=CC(=O)CC(C2)C3=CC=CC=C3)OC |
Product Overview
3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one (CAS 312501-01-2), with molecular formula C20H21NO3 and molecular weight 323.15 g/mol. IUPAC: 3-(2,4-dimethoxyanilino)-5-phenylcyclohex-2-en-1-one.
Chemical Property Profile of 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one
Property Insights of 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one
The XLogP value of 4.1463 indicates that 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-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-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one has 1 hydrogen bond donor(s) and 4 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-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one?
The CAS number of 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one is 312501-01-2.
What is the molecular formula of 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one?
The molecular formula of 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one is C20H21NO3.
What is the molecular weight of 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one?
The molecular weight of 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one is 323.15 g/mol.
Where can I buy 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one?
You can request a quote for 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-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-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.