7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one

C22H16O4 — CID 7140080

IUPAC7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one
SMILESCc1oc2cc(O)ccc2c(=O)c1Oc1ccccc1-c1ccccc1
InChIInChI=1S/C22H16O4/c1-14-22(21(24)18-12-11-16(23)13-20(18)25-14)26-19-10-6-5-9-17(19)15-7-3-2-4-8-15/h2-13,23H,1H3
InChIKeyRKAJBELIALTLEX-UHFFFAOYSA-N
MW344.37 g/mol
LogP5.27
Rot. Bonds3

About 7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one

7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one (PubChem CID 7140080) has the molecular formula C22H16O4 and a molecular weight of 344.37 g/mol. Its IUPAC name is 7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one.

Molecular Properties

Compound Name7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one
PubChem CID7140080
Molecular FormulaC22H16O4
Molecular Weight344.37 g/mol
Exact Mass344.10
IUPAC Name7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one
SMILESCc1oc2cc(O)ccc2c(=O)c1Oc1ccccc1-c1ccccc1
InChIInChI=1S/C22H16O4/c1-14-22(21(24)18-12-11-16(23)13-20(18)25-14)26-19-10-6-5-9-17(19)15-7-3-2-4-8-15/h2-13,23H,1H3
InChIKeyRKAJBELIALTLEX-UHFFFAOYSA-N
XLogP5.27
TPSA59.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.37
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Quercetin
CID 5280343
Genistein
CID 5280961
Myricetin
CID 5281672
Octabenzone
CID 15797
Apigenin
CID 5280443
Diosmetin
CID 5281612
2-Hydroxy-4-methoxybenzophenone
CID 4632
Silibinin
CID 31553
Daidzin
CID 107971
Naringenin
CID 439246
Formononetin
CID 5280378
Luteolin
CID 5280445

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one?
The IUPAC name of 7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one (CID 7140080) is 7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one.
What is the SMILES notation for 7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one?
The canonical SMILES for 7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one is Cc1oc2cc(O)ccc2c(=O)c1Oc1ccccc1-c1ccccc1.
What is the InChIKey of 7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one?
The InChIKey is RKAJBELIALTLEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16O4/c1-14-22(21(24)18-12-11-16(23)13-20(18)25-14)26-19-10-6-5-9-17(19)15-7-3-2-4-8-15/h2-13,23H,1H3.
What are the key properties of 7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one?
7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one has a molecular weight of 344.37 g/mol, XLogP of 5.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-2-methyl-3-(2-phenylphenoxy)chromen-4-one is sourced from PubChem (CID 7140080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).