4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate
TL;DR: 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate (CAS 208446-30-4) is a chemical compound with molecular formula C16H12O5S and molecular weight 316.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-oxo-3-phenylchromen-7-yl) methanesulfonate
Also Known As: 7-(Mesyloxy)isoflavone, 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate, (4-oxo-3-phenylchromen-7-yl) methanesulfonate, 4-oxo-3-phenylchromen-7-yl methylsulfonate, VU0510166-1
| Molecular Formula | C16H12O5S |
|---|---|
| Molecular Weight | 316.04 g/mol |
| LogP | 2.7984 |
| Topological Polar Surface Area | 73.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.04056 |
| Heavy Atoms | 22 |
| Complexity | 987.97 |
Chemical Identifiers
| CAS Number | 208446-30-4 |
|---|---|
| SMILES | CS(=O)(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=CC=C3 |
Product Overview
4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate (CAS 208446-30-4), with molecular formula C16H12O5S and molecular weight 316.04 g/mol. IUPAC: (4-oxo-3-phenylchromen-7-yl) methanesulfonate.
Chemical Property Profile of 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate
Property Insights of 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate
The XLogP value of 2.7984 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate. The TPSA of 73.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate. Following Lipinski's Rule of Five, 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate has 0 hydrogen bond donor(s) and 5 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 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate?
The CAS number of 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate is 208446-30-4.
What is the molecular formula of 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate?
The molecular formula of 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate is C16H12O5S.
What is the molecular weight of 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate?
The molecular weight of 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate is 316.04 g/mol.
Where can I buy 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate?
You can request a quote for 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-oxo-3-phenyl-4H-chromen-7-yl methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.