(2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone
TL;DR: (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone (CAS 5221-53-4) is a chemical compound with molecular formula C23H24O5 and molecular weight 380.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,5E)-2,5-bis[(2,3-dimethoxyphenyl)methylidene]cyclopentan-1-one
Also Known As: DIMETHIRIMOL, BIM-0014334.P001, (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone, 2,5-bis(2,3-dimethoxybenzylidene)cyclopentanone, (2E,5E)-2,5-bis[(2,3-dimethoxyphenyl)methylidene]cyclopentan-1-one
| Molecular Formula | C23H24O5 |
|---|---|
| Molecular Weight | 380.16 g/mol |
| LogP | 4.5509 |
| Topological Polar Surface Area | 53.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 380.16238 |
| Heavy Atoms | 28 |
| Complexity | 864.504 |
Chemical Identifiers
| CAS Number | 5221-53-4 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)/C=C\2/C(=O)/C(=C/C3=C(C(=CC=C3)OC)OC)/CC2 |
Product Overview
(2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone (CAS 5221-53-4), with molecular formula C23H24O5 and molecular weight 380.16 g/mol. IUPAC: (2E,5E)-2,5-bis[(2,3-dimethoxyphenyl)methylidene]cyclopentan-1-one.
Chemical Property Profile of (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone
Property Insights of (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone
The XLogP value of 4.5509 indicates that (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.99 Ų, (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone has 0 hydrogen bond donor(s) and 5 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 (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone?
The CAS number of (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone is 5221-53-4.
What is the molecular formula of (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone?
The molecular formula of (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone is C23H24O5.
What is the molecular weight of (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone?
The molecular weight of (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone is 380.16 g/mol.
Where can I buy (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone?
You can request a quote for (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone?
Yes, KEHONG BIO provides custom synthesis services for (2E,5E)-2,5-Bis(2,3-dimethoxybenzylidene)cyclopentanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.