2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one
TL;DR: 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one (CAS 5706-15-0) is a chemical compound with molecular formula C18H16O3 and molecular weight 280.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,4-dimethoxyphenyl)methylidene]-3H-inden-1-one
Also Known As: NCI60_014640, 2-[(3,4-dimethoxyphenyl)methylidene]-3H-inden-1-one, 2-[(3,4-Dimethoxyphenyl)methylene]-2,3-dihydro-1H-inden-1-one, 2-(3,4-dimethoxybenzylidene)-2,3-dihydro-1h-inden-1-one, 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one
| Molecular Formula | C18H16O3 |
|---|---|
| Molecular Weight | 280.11 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.10995 |
| Heavy Atoms | 21 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 5706-15-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=C2CC3=CC=CC=C3C2=O)OC |
| InChIKey | FJGZVPFZRZDBNC-UHFFFAOYSA-N |
Product Overview
2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one (CAS 5706-15-0), with molecular formula C18H16O3 and molecular weight 280.11 g/mol. IUPAC: 2-[(3,4-dimethoxyphenyl)methylidene]-3H-inden-1-one.
Chemical Property Profile of 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one
Property Insights of 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one
The XLogP value of 3.7 indicates that 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one has 0 hydrogen bond donor(s) and 3 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-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one?
The CAS number of 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one is 5706-15-0.
What is the molecular formula of 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one?
The molecular formula of 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one is C18H16O3.
What is the molecular weight of 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one?
The molecular weight of 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one is 280.11 g/mol.
Where can I buy 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one?
You can request a quote for 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-((3,4-Dimethoxyphenyl)methylene)-2,3-dihydro-1H-inden-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.