2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one

C24H20N2O — CID 2940266

IUPAC2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one
SMILESO=c1c2ccccc2nc(C=Cc2ccccc2)n1CCc1ccccc1
InChIInChI=1S/C24H20N2O/c27-24-21-13-7-8-14-22(21)25-23(16-15-19-9-3-1-4-10-19)26(24)18-17-20-11-5-2-6-12-20/h1-16H,17-18H2
InChIKeyDSUBGHYDPIPQKP-UHFFFAOYSA-N
MW352.44 g/mol
LogP4.81
Rot. Bonds5

About 2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one

2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one (PubChem CID 2940266) has the molecular formula C24H20N2O and a molecular weight of 352.44 g/mol. Its IUPAC name is 2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one.

Molecular Properties

Compound Name2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one
PubChem CID2940266
Molecular FormulaC24H20N2O
Molecular Weight352.44 g/mol
Exact Mass352.16
IUPAC Name2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one
SMILESO=c1c2ccccc2nc(C=Cc2ccccc2)n1CCc1ccccc1
InChIInChI=1S/C24H20N2O/c27-24-21-13-7-8-14-22(21)25-23(16-15-19-9-3-1-4-10-19)26(24)18-17-20-11-5-2-6-12-20/h1-16H,17-18H2
InChIKeyDSUBGHYDPIPQKP-UHFFFAOYSA-N
XLogP4.81
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-hydroxyethyl)-2-(2-phenylethenyl)quinazolin-4-one
CID 71374590
3-benzyl-2-[(E)-2-pyridin-4-ylethenyl]quinazolin-4-one
CID 53245550
2-[2-(4-chlorophenyl)ethenyl]-3-[(4-chlorophenyl)methyl]quinazolin-4-one
CID 71833929
3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]quinazolin-4-one
CID 3849018
2-[(E)-2-(1-benzyl-2-methylindol-3-yl)ethenyl]-3-(3-hydroxypropyl)quinazolin-4-one
CID 23606618
3-(2-hydroxyethyl)-2-[2-(4-nitrophenyl)ethenyl]quinazolin-4-one
CID 3140396
2-[(Z)-(1,5-dimethyl-2-oxoindol-3-ylidene)methyl]-3-(2-phenylethyl)quinazolin-4-one
CID 6223414
3-ethyl-2-[(Z)-2-(3-methylphenyl)ethenyl]quinazolin-4-one
CID 7334704
2-[2-(1-benzylindol-3-yl)ethenyl]-3-ethylquinazolin-4-one
CID 2870092
2-[(Z)-2-(1,2-dimethylindol-3-yl)ethenyl]-3-ethylquinazolin-4-one
CID 92912504
3-[2-[(E)-2-(3-cyanophenyl)ethenyl]-4-oxoquinazolin-3-yl]propanoic acid
CID 36979873
3-[(4-chlorophenyl)methyl]-2-[(E)-2-pyridin-3-ylethenyl]quinazolin-4-one
CID 53245568

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one?
The IUPAC name of 2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one (CID 2940266) is 2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one.
What is the SMILES notation for 2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one?
The canonical SMILES for 2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one is O=c1c2ccccc2nc(C=Cc2ccccc2)n1CCc1ccccc1.
What is the InChIKey of 2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one?
The InChIKey is DSUBGHYDPIPQKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O/c27-24-21-13-7-8-14-22(21)25-23(16-15-19-9-3-1-4-10-19)26(24)18-17-20-11-5-2-6-12-20/h1-16H,17-18H2.
What are the key properties of 2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one?
2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one has a molecular weight of 352.44 g/mol, XLogP of 4.81, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylethenyl)-3-(2-phenylethyl)quinazolin-4-one is sourced from PubChem (CID 2940266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).