3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one
TL;DR: 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one (CAS 129414-77-3) is a chemical compound with molecular formula C18H15BrO3 and molecular weight 358.02045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-bromophenyl)-6-ethyl-7-methoxychromen-4-one
Also Known As: 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one, 3-(4-bromophenyl)-6-ethyl-7-methoxychromen-4-one, VU0088379-2, F0196-0670
Technical Specifications
| Molecular Formula | C18H15BrO3 |
| Molecular Weight | 358.02045 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.02045 Da |
| Heavy Atoms | 22 |
| Complexity | 440.0 |
| SMILES | CCC1=CC2=C(C=C1OC)OC=C(C2=O)C3=CC=C(C=C3)Br |
| InChIKey | XKANEMGKQYTWGN-UHFFFAOYSA-N |
Chemical Property Profile of 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one
Property Insights of 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one
The XLogP value of 4.6 indicates that 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-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, 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-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
What is the CAS number of 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one?
The CAS number of 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one is 129414-77-3.
What is the molecular formula of 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one?
The molecular formula of 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one is C18H15BrO3.
What is the molecular weight of 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one?
The molecular weight of 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one is 358.02045 g/mol.
Where can I buy 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one?
You can request a quote for 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one?
Yes, CoreyChem provides custom synthesis services for 3-(4-bromophenyl)-6-ethyl-7-methoxy-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.