(2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone

C26H20O3 — CID 10948907

IUPAC(2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone
SMILESCOc1cc(C(=O)c2ccccc2)c(O)c(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C26H20O3/c1-29-22-17-21(25(27)20-15-9-4-10-16-20)26(28)24(19-13-7-3-8-14-19)23(22)18-11-5-2-6-12-18/h2-17,28H,1H3
InChIKeyULJSFHTVNMZBKV-UHFFFAOYSA-N
MW380.44 g/mol
LogP5.97
Rot. Bonds5

About (2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone

(2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone (PubChem CID 10948907) has the molecular formula C26H20O3 and a molecular weight of 380.44 g/mol. Its IUPAC name is (2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone.

Molecular Properties

Compound Name(2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone
PubChem CID10948907
Molecular FormulaC26H20O3
Molecular Weight380.44 g/mol
Exact Mass380.14
IUPAC Name(2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone
SMILESCOc1cc(C(=O)c2ccccc2)c(O)c(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C26H20O3/c1-29-22-17-21(25(27)20-15-9-4-10-16-20)26(28)24(19-13-7-3-8-14-19)23(22)18-11-5-2-6-12-18/h2-17,28H,1H3
InChIKeyULJSFHTVNMZBKV-UHFFFAOYSA-N
XLogP5.97
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.44
LogP ≤ 55.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-hydroxy-3,5-dimethoxy-4-methylphenyl)-phenylmethanone
CID 174443655
(4-methylphenyl)-(3,4,5-trimethoxy-2-phenylphenyl)methanone
CID 71574701
(2-hydroxy-5-methoxy-4-methylphenyl)-phenylmethanone;methane
CID 175255493
(3-methoxynaphthalen-2-yl)-phenylmethanone
CID 15855764
(4-hydroxy-9-methoxy-1-phenyldibenzofuran-3-yl)-phenylmethanone
CID 132522589
(2-benzoyl-4,5-dimethoxyphenyl) benzoate
CID 141249986
bis(3-methoxy-2-phenylphenyl)methanone
CID 141103935
4-methoxy-1-phenylnaphthalene-2-carboxylic acid
CID 12870686
(5-iodo-2-methoxyphenyl)-phenylmethanone
CID 43161664
(2,3-dihydroxy-4-methoxyphenyl)-phenylmethanone;(2,4-dihydroxyphenyl)-phenylmethanone
CID 159803973
(3-ethyl-2-hydroxy-4-methoxyphenyl)-phenylmethanone
CID 18714090
phenyl-(2,3,4-trihydroxy-5,6-diphenylphenyl)methanone
CID 172846091

Frequently Asked Questions

What is the IUPAC name of (2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone?
The IUPAC name of (2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone (CID 10948907) is (2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone.
What is the SMILES notation for (2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone?
The canonical SMILES for (2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone is COc1cc(C(=O)c2ccccc2)c(O)c(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of (2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone?
The InChIKey is ULJSFHTVNMZBKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20O3/c1-29-22-17-21(25(27)20-15-9-4-10-16-20)26(28)24(19-13-7-3-8-14-19)23(22)18-11-5-2-6-12-18/h2-17,28H,1H3.
What are the key properties of (2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone?
(2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone has a molecular weight of 380.44 g/mol, XLogP of 5.97, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxy-5-methoxy-3,4-diphenylphenyl)-phenylmethanone is sourced from PubChem (CID 10948907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).