2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one

C20H16N2O — CID 4793207

IUPAC2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one
SMILESO=C1NC(c2ccc(-c3ccccc3)cc2)Nc2ccccc21
InChIInChI=1S/C20H16N2O/c23-20-17-8-4-5-9-18(17)21-19(22-20)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13,19,21H,(H,22,23)
InChIKeyXRUAOBKXCFNPCK-UHFFFAOYSA-N
MW300.36 g/mol
LogP4.21
Rot. Bonds2

About 2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one

2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one (PubChem CID 4793207) has the molecular formula C20H16N2O and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one.

Molecular Properties

Compound Name2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one
PubChem CID4793207
Molecular FormulaC20H16N2O
Molecular Weight300.36 g/mol
Exact Mass300.13
IUPAC Name2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one
SMILESO=C1NC(c2ccc(-c3ccccc3)cc2)Nc2ccccc21
InChIInChI=1S/C20H16N2O/c23-20-17-8-4-5-9-18(17)21-19(22-20)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13,19,21H,(H,22,23)
InChIKeyXRUAOBKXCFNPCK-UHFFFAOYSA-N
XLogP4.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one?
The IUPAC name of 2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one (CID 4793207) is 2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one.
What is the SMILES notation for 2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one?
The canonical SMILES for 2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one is O=C1NC(c2ccc(-c3ccccc3)cc2)Nc2ccccc21.
What is the InChIKey of 2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one?
The InChIKey is XRUAOBKXCFNPCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O/c23-20-17-8-4-5-9-18(17)21-19(22-20)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13,19,21H,(H,22,23).
What are the key properties of 2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one?
2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one has a molecular weight of 300.36 g/mol, XLogP of 4.21, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylphenyl)-2,3-dihydro-1H-quinazolin-4-one is sourced from PubChem (CID 4793207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).