[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone

C32H22O2 — CID 19009361

IUPAC[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone
SMILESO=C(c1ccc(-c2ccccc2)cc1)c1cccc(C(=O)c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C32H22O2/c33-31(27-18-14-25(15-19-27)23-8-3-1-4-9-23)29-12-7-13-30(22-29)32(34)28-20-16-26(17-21-28)24-10-5-2-6-11-24/h1-22H
InChIKeyVLTKLVZRHKYFJN-UHFFFAOYSA-N
MW438.53 g/mol
LogP7.48
Rot. Bonds6

About [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone

[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone (PubChem CID 19009361) has the molecular formula C32H22O2 and a molecular weight of 438.53 g/mol. Its IUPAC name is [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone.

Molecular Properties

Compound Name[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone
PubChem CID19009361
Molecular FormulaC32H22O2
Molecular Weight438.53 g/mol
Exact Mass438.16
IUPAC Name[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone
SMILESO=C(c1ccc(-c2ccccc2)cc1)c1cccc(C(=O)c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C32H22O2/c33-31(27-18-14-25(15-19-27)23-8-3-1-4-9-23)29-12-7-13-30(22-29)32(34)28-20-16-26(17-21-28)24-10-5-2-6-11-24/h1-22H
InChIKeyVLTKLVZRHKYFJN-UHFFFAOYSA-N
XLogP7.48
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.53
LogP ≤ 57.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

phenyl-(4-phenylphenyl)methanone
CID 155775877
(3-benzoylphenyl)-phenylmethanone;ethane
CID 145125865
4-[3-(4-carboxybenzoyl)benzoyl]benzoic acid
CID 22561490
phenyl-[4-[3-(trifluoromethyl)phenyl]phenyl]methanone
CID 132564507
[4-(4-boranylphenyl)phenyl]-phenylmethanone
CID 88897170
ethane;[4-[4-[4-[4-(4-methylphenyl)phenyl]phenyl]phenyl]phenyl]-phenylmethanone
CID 159022602
diphenylmethanone
CID 3102
3-phenylbenzoic acid;4-phenylbenzoic acid
CID 161256783
3-(3-carboxybenzoyl)benzoic acid
CID 754396
[3-[3-amino-4-(4-phenylphenoxy)benzoyl]phenyl]-[3-amino-4-(4-phenylphenoxy)phenyl]methanone
CID 139806354
(4-phenylphenyl)-(3,4,5-trifluorophenyl)methanone
CID 146008045
(3-methylphenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone
CID 87107427

Frequently Asked Questions

What is the IUPAC name of [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone?
The IUPAC name of [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone (CID 19009361) is [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone.
What is the SMILES notation for [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone?
The canonical SMILES for [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone is O=C(c1ccc(-c2ccccc2)cc1)c1cccc(C(=O)c2ccc(-c3ccccc3)cc2)c1.
What is the InChIKey of [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone?
The InChIKey is VLTKLVZRHKYFJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H22O2/c33-31(27-18-14-25(15-19-27)23-8-3-1-4-9-23)29-12-7-13-30(22-29)32(34)28-20-16-26(17-21-28)24-10-5-2-6-11-24/h1-22H.
What are the key properties of [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone?
[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone has a molecular weight of 438.53 g/mol, XLogP of 7.48, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone is sourced from PubChem (CID 19009361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).