[4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone

C26H18O3 — CID 121317125

IUPAC[4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc(-c2cc(O)ccc2C(=O)c2ccccc2)cc1
InChIInChI=1S/C26H18O3/c27-22-15-16-23(26(29)20-9-5-2-6-10-20)24(17-22)18-11-13-21(14-12-18)25(28)19-7-3-1-4-8-19/h1-17,27H
InChIKeyJJWIFIUVWIIWEX-UHFFFAOYSA-N
MW378.43 g/mol
LogP5.52
Rot. Bonds5

About [4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone

[4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone (PubChem CID 121317125) has the molecular formula C26H18O3 and a molecular weight of 378.43 g/mol. Its IUPAC name is [4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone.

Molecular Properties

Compound Name[4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone
PubChem CID121317125
Molecular FormulaC26H18O3
Molecular Weight378.43 g/mol
Exact Mass378.13
IUPAC Name[4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc(-c2cc(O)ccc2C(=O)c2ccccc2)cc1
InChIInChI=1S/C26H18O3/c27-22-15-16-23(26(29)20-9-5-2-6-10-20)24(17-22)18-11-13-21(14-12-18)25(28)19-7-3-1-4-8-19/h1-17,27H
InChIKeyJJWIFIUVWIIWEX-UHFFFAOYSA-N
XLogP5.52
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.43
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[5-hydroxy-2-(4-hydroxyphenyl)phenyl]phenyl]-phenylmethanone
CID 141056080
(4-hydroxyphenyl)-phenylmethanone
CID 139062648
potassium 4-hydroxy-2-phenylbenzoate
CID 69113981
phenyl-(4-phenylphenyl)methanone
CID 155775877
[2-hydroxy-5-(4-hydroxyphenyl)phenyl]-phenylmethanone
CID 15262738
2-[4-(2-carboxy-5-hydroxyphenyl)-3-phenylphenyl]-4-hydroxybenzoic acid
CID 69497360
acetic acid;(3-hydroxyphenyl)-[4-(4-hydroxyphenyl)phenyl]methanone
CID 86741070
phenyl-[2-(2-phenylbenzoyl)phenyl]methanone
CID 141429590
[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone
CID 19009361
diphenylmethanone
CID 3102
[2-(4-bromophenyl)-4-nitrophenyl]-phenylmethanone
CID 174903264
(4-hydroxyphenyl)-phenylmethanone;phenyl hydrogen carbonate
CID 118078754

Frequently Asked Questions

What is the IUPAC name of [4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone?
The IUPAC name of [4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone (CID 121317125) is [4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone.
What is the SMILES notation for [4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone?
The canonical SMILES for [4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone is O=C(c1ccccc1)c1ccc(-c2cc(O)ccc2C(=O)c2ccccc2)cc1.
What is the InChIKey of [4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone?
The InChIKey is JJWIFIUVWIIWEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18O3/c27-22-15-16-23(26(29)20-9-5-2-6-10-20)24(17-22)18-11-13-21(14-12-18)25(28)19-7-3-1-4-8-19/h1-17,27H.
What are the key properties of [4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone?
[4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone has a molecular weight of 378.43 g/mol, XLogP of 5.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-benzoyl-5-hydroxyphenyl)phenyl]-phenylmethanone is sourced from PubChem (CID 121317125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).