3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate
TL;DR: 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate (CAS 610752-14-2) is a chemical compound with molecular formula C19H15BrO4 and molecular weight 386.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-bromophenyl)-2-methyl-4-oxochromen-7-yl] propanoate
Also Known As: 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate, VU0043131-2, 3-(4-bromophenyl)-2-methyl-4-oxochromen-7-yl propanoate, [3-(4-bromophenyl)-2-methyl-4-oxochromen-7-yl] propanoate, F3139-1469
| Molecular Formula | C19H15BrO4 |
|---|---|
| Molecular Weight | 386.02 g/mol |
| LogP | 4.84632 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.01538 |
| Heavy Atoms | 24 |
| Complexity | 971.0636 |
Chemical Identifiers
| CAS Number | 610752-14-2 |
|---|---|
| SMILES | CCC(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C)C3=CC=C(C=C3)Br |
Product Overview
3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate (CAS 610752-14-2), with molecular formula C19H15BrO4 and molecular weight 386.02 g/mol. IUPAC: [3-(4-bromophenyl)-2-methyl-4-oxochromen-7-yl] propanoate.
Chemical Property Profile of 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate
Property Insights of 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate
The XLogP value of 4.84632 indicates that 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate has 0 hydrogen bond donor(s) and 4 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 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate?
The CAS number of 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate is 610752-14-2.
What is the molecular formula of 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate?
The molecular formula of 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate is C19H15BrO4.
What is the molecular weight of 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate?
The molecular weight of 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate is 386.02 g/mol.
Where can I buy 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate?
You can request a quote for 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-bromophenyl)-2-methyl-4-oxo-4H-chromen-7-yl propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.