2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone
TL;DR: 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone (CAS 126717-77-9) is a chemical compound with molecular formula C18H15BrO2 and molecular weight 342.02554 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E)-2-[(4-bromophenyl)methylidene]-6-methoxy-3,4-dihydronaphthalen-1-one
Also Known As: BIM-0025934.P001, 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone, AB01314968-02, AI-346/11356035, (2E)-2-(4-bromobenzylidene)-6-methoxy-3,4-dihydronaphthalen-1(2H)-one
Technical Specifications
| Molecular Formula | C18H15BrO2 |
| Molecular Weight | 342.02554 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 342.02554 Da |
| Heavy Atoms | 21 |
| Complexity | 409.0 |
| SMILES | COC1=CC2=C(C=C1)C(=O)/C(=C/C3=CC=C(C=C3)Br)/CC2 |
| InChIKey | KDXPBXKMTJKZLE-GXDHUFHOSA-N |
Chemical Property Profile of 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone
Property Insights of 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone
The XLogP value of 4.7 indicates that 2-(4-bromobenzylidene)-6-methoxy-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 26.3 Ų, 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone?
The CAS number of 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone is 126717-77-9.
What is the molecular formula of 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone?
The molecular formula of 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone is C18H15BrO2.
What is the molecular weight of 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone?
The molecular weight of 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone is 342.02554 g/mol.
Where can I buy 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone?
You can request a quote for 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone?
Yes, CoreyChem provides custom synthesis services for 2-(4-bromobenzylidene)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.