5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one

C24H18O4 — CID 6802595

IUPAC5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one
SMILESO=c1cc(-c2ccccc2)oc2cc(OCC=Cc3ccccc3)cc(O)c12
InChIInChI=1S/C24H18O4/c25-20-14-19(27-13-7-10-17-8-3-1-4-9-17)15-23-24(20)21(26)16-22(28-23)18-11-5-2-6-12-18/h1-12,14-16,25H,13H2
InChIKeyVXRQEDMGPFPQNN-UHFFFAOYSA-N
MW370.40 g/mol
LogP5.26
Rot. Bonds5

About 5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one

5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one (PubChem CID 6802595) has the molecular formula C24H18O4 and a molecular weight of 370.40 g/mol. Its IUPAC name is 5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one.

Molecular Properties

Compound Name5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one
PubChem CID6802595
Molecular FormulaC24H18O4
Molecular Weight370.40 g/mol
Exact Mass370.12
IUPAC Name5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one
SMILESO=c1cc(-c2ccccc2)oc2cc(OCC=Cc3ccccc3)cc(O)c12
InChIInChI=1S/C24H18O4/c25-20-14-19(27-13-7-10-17-8-3-1-4-9-17)15-23-24(20)21(26)16-22(28-23)18-11-5-2-6-12-18/h1-12,14-16,25H,13H2
InChIKeyVXRQEDMGPFPQNN-UHFFFAOYSA-N
XLogP5.26
TPSA59.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.40
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one
CID 15896568
7-[(4-bromophenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one
CID 6029612
7-(8-bromooctoxy)-5-hydroxy-2-phenylchromen-4-one
CID 172994912
8-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyoctanoic acid
CID 172994915
5-hydroxy-7-(3-methylbut-2-enoxy)-2-[4-(3-methylbut-2-enoxy)phenyl]chromen-4-one
CID 131859007
bis(5,7-dihydroxy-2-phenylchromen-4-one);sulfuric acid
CID 174670813
7-[2-(benzylamino)ethoxy]-5-hydroxy-2-phenylchromen-4-one
CID 46898624
5,7-dihydroxy-2-phenylchromen-4-one;2-phenylchromen-4-one
CID 68816707
5,7-dihydroxy-2-phenylchromen-4-one;5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one
CID 69450862
7-(4-bromo-2,4-dimethylpentan-2-yl)oxy-5-hydroxy-2-phenylchromen-4-one
CID 91144753
1-[2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyacetyl]piperidine-4-carboxylic acid
CID 29147856
5-hydroxy-7-methoxy-2-phenylchromen-4-one;2-phenylchromen-4-one
CID 161118058

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one?
The IUPAC name of 5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one (CID 6802595) is 5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one.
What is the SMILES notation for 5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one?
The canonical SMILES for 5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one is O=c1cc(-c2ccccc2)oc2cc(OCC=Cc3ccccc3)cc(O)c12.
What is the InChIKey of 5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one?
The InChIKey is VXRQEDMGPFPQNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18O4/c25-20-14-19(27-13-7-10-17-8-3-1-4-9-17)15-23-24(20)21(26)16-22(28-23)18-11-5-2-6-12-18/h1-12,14-16,25H,13H2.
What are the key properties of 5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one?
5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one has a molecular weight of 370.40 g/mol, XLogP of 5.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one is sourced from PubChem (CID 6802595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).