2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one

C21H18N2O2 — CID 2853474

IUPAC2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one
SMILESCOc1ccc(C2Nc3ccccc3C(=O)N2c2ccccc2)cc1
InChIInChI=1S/C21H18N2O2/c1-25-17-13-11-15(12-14-17)20-22-19-10-6-5-9-18(19)21(24)23(20)16-7-3-2-4-8-16/h2-14,20,22H,1H3
InChIKeyMUEJIPMUQXCYNL-UHFFFAOYSA-N
MW330.39 g/mol
LogP4.47
Rot. Bonds3

About 2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one

2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one (PubChem CID 2853474) has the molecular formula C21H18N2O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one
PubChem CID2853474
Molecular FormulaC21H18N2O2
Molecular Weight330.39 g/mol
Exact Mass330.14
IUPAC Name2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one
SMILESCOc1ccc(C2Nc3ccccc3C(=O)N2c2ccccc2)cc1
InChIInChI=1S/C21H18N2O2/c1-25-17-13-11-15(12-14-17)20-22-19-10-6-5-9-18(19)21(24)23(20)16-7-3-2-4-8-16/h2-14,20,22H,1H3
InChIKeyMUEJIPMUQXCYNL-UHFFFAOYSA-N
XLogP4.47
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Encainide
CID 48041
N-(3-(4-((4-(3,4-Dihydro-2-oxo-1(2H)-quinolinyl)-1-piperidinyl)carbonyl)phenoxy)propyl)acetamide
CID 114904
Encainide Hydrochloride
CID 48040
1,2-Dihydro-2-(4-methoxyphenyl)-4(3H)-quinazolinone
CID 484118
3-[(2-Methoxyphenyl)methyl]-2-sulfanyl-3,4-dihydroquinazolin-4-one
CID 866360
2-(3-(Benzyloxy)phenyl)-2,3-dihydroquinazolin-4(1H)-one
CID 300572
2-(2-ethoxyphenyl)-2,3-dihydro-1H-quinazolin-4-one
CID 292560
1,2-Dihydro-2-(3,4-(methylenedioxy)-phenyl)-4(3H)-quinazolinone
CID 650393
3,4-dihydro-1(2H)-quinolinyl(4-methoxyphenyl)methanone
CID 710667
4-Methoxy-N-(2-(4-(2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)piperidin-1-yl)ethyl)benzamide
CID 21428971
N-[3-(3-methoxyphenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]butanamide
CID 4906475
3-[2-[4-(2-Methoxyphenyl)-1-piperazinyl]ethyl]-2,4(1H,3H)-quinazolinedione
CID 122065

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one?
The IUPAC name of 2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one (CID 2853474) is 2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one.
What is the SMILES notation for 2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one?
The canonical SMILES for 2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one is COc1ccc(C2Nc3ccccc3C(=O)N2c2ccccc2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one?
The InChIKey is MUEJIPMUQXCYNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O2/c1-25-17-13-11-15(12-14-17)20-22-19-10-6-5-9-18(19)21(24)23(20)16-7-3-2-4-8-16/h2-14,20,22H,1H3.
What are the key properties of 2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one?
2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one has a molecular weight of 330.39 g/mol, XLogP of 4.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one is sourced from PubChem (CID 2853474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).