3-(4-methoxyphenyl)-2-phenylquinazolin-4-one

C21H16N2O2 — CID 708934

IUPAC3-(4-methoxyphenyl)-2-phenylquinazolin-4-one
SMILESCOc1ccc(-n2c(-c3ccccc3)nc3ccccc3c2=O)cc1
InChIInChI=1S/C21H16N2O2/c1-25-17-13-11-16(12-14-17)23-20(15-7-3-2-4-8-15)22-19-10-6-5-9-18(19)21(23)24/h2-14H,1H3
InChIKeyQCGYQXYRANAOSN-UHFFFAOYSA-N
MW328.37 g/mol
LogP4.06
Rot. Bonds3

About 3-(4-methoxyphenyl)-2-phenylquinazolin-4-one

3-(4-methoxyphenyl)-2-phenylquinazolin-4-one (PubChem CID 708934) has the molecular formula C21H16N2O2 and a molecular weight of 328.37 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-2-phenylquinazolin-4-one.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-2-phenylquinazolin-4-one
PubChem CID708934
Molecular FormulaC21H16N2O2
Molecular Weight328.37 g/mol
Exact Mass328.12
IUPAC Name3-(4-methoxyphenyl)-2-phenylquinazolin-4-one
SMILESCOc1ccc(-n2c(-c3ccccc3)nc3ccccc3c2=O)cc1
InChIInChI=1S/C21H16N2O2/c1-25-17-13-11-16(12-14-17)23-20(15-7-3-2-4-8-15)22-19-10-6-5-9-18(19)21(23)24/h2-14H,1H3
InChIKeyQCGYQXYRANAOSN-UHFFFAOYSA-N
XLogP4.06
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-(4-methoxyphenyl)-2-phenylquinazolin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-methoxyphenyl)-3-pyridin-4-ylquinazolin-4-one
CID 829457
3-[4-(2-methylphenoxy)phenyl]-2-phenylquinazolin-4-one
CID 71318579
3-(4-methoxyphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)quinazolin-4-one
CID 91398896
3-[3,5-bis(4-oxo-2-phenylquinazolin-3-yl)phenyl]-2-phenylquinazolin-4-one
CID 121247436
2-amino-3-(4-methoxyphenyl)quinazolin-4-one
CID 71652488
2-(4-phenylphenyl)-3-pyridin-4-ylquinazolin-4-one
CID 1047183
2,3-bis(4-bromophenyl)quinazolin-4-one
CID 3707353
5-(4-methoxyphenyl)-1,6-diphenylpyrazolo[5,4-d]pyrimidin-4-one
CID 67281727
3-(4-methoxyphenyl)-2-methylsulfanylquinazolin-4-one
CID 659793
3-(4-butan-2-ylphenyl)-2-(3,5-dimethoxyphenyl)quinazolin-4-one
CID 24720134
3-(4-nitrophenyl)-2-phenylquinazolin-4-one
CID 921318
3-(4-methoxyphenyl)-2-(trifluoromethyl)quinazolin-4-one
CID 3970898

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-2-phenylquinazolin-4-one?
The IUPAC name of 3-(4-methoxyphenyl)-2-phenylquinazolin-4-one (CID 708934) is 3-(4-methoxyphenyl)-2-phenylquinazolin-4-one.
What is the SMILES notation for 3-(4-methoxyphenyl)-2-phenylquinazolin-4-one?
The canonical SMILES for 3-(4-methoxyphenyl)-2-phenylquinazolin-4-one is COc1ccc(-n2c(-c3ccccc3)nc3ccccc3c2=O)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-2-phenylquinazolin-4-one?
The InChIKey is QCGYQXYRANAOSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O2/c1-25-17-13-11-16(12-14-17)23-20(15-7-3-2-4-8-15)22-19-10-6-5-9-18(19)21(23)24/h2-14H,1H3.
What are the key properties of 3-(4-methoxyphenyl)-2-phenylquinazolin-4-one?
3-(4-methoxyphenyl)-2-phenylquinazolin-4-one has a molecular weight of 328.37 g/mol, XLogP of 4.06, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-2-phenylquinazolin-4-one is sourced from PubChem (CID 708934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).