2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone
TL;DR: 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone (CAS 444890-66-8) is a chemical compound with molecular formula C19H18O3 and molecular weight 294.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[(2,4-dimethoxyphenyl)methylidene]-3,4-dihydronaphthalen-1-one
Also Known As: 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone, (e)-2-(2',4'-dimethoxybenzylidene)-1-tetralone, AI-211/12452016, (2E)-2-[(2,4-dimethoxyphenyl)methylidene]-3,4-dihydronaphthalen-1-one, (2E)-2-[(2,4-DIMETHOXYPHENYL)METHYLIDENE]-1,2,3,4-TETRAHYDRONAPHTHALEN-1-ONE
| Molecular Formula | C19H18O3 |
|---|---|
| Molecular Weight | 294.13 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.12558 |
| Heavy Atoms | 22 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 444890-66-8 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)/C=C/2\CCC3=CC=CC=C3C2=O)OC |
| InChIKey | FJDDRTSHMRZSMG-RVDMUPIBSA-N |
Product Overview
2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone (CAS 444890-66-8), with molecular formula C19H18O3 and molecular weight 294.13 g/mol. IUPAC: (2E)-2-[(2,4-dimethoxyphenyl)methylidene]-3,4-dihydronaphthalen-1-one.
Chemical Property Profile of 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone
Property Insights of 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone
The XLogP value of 4.0 indicates that 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone 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-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone 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-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone?
The CAS number of 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone is 444890-66-8.
What is the molecular formula of 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone?
The molecular formula of 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone is C19H18O3.
What is the molecular weight of 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone?
The molecular weight of 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone is 294.13 g/mol.
Where can I buy 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone?
You can request a quote for 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-dimethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.