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

C20H16N2O2 — CID 2888388

IUPAC2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one
SMILESO=C1c2ccccc2NC(c2cccc(O)c2)N1c1ccccc1
InChIInChI=1S/C20H16N2O2/c23-16-10-6-7-14(13-16)19-21-18-12-5-4-11-17(18)20(24)22(19)15-8-2-1-3-9-15/h1-13,19,21,23H
InChIKeyVKEATZROJSMVBC-UHFFFAOYSA-N
MW316.36 g/mol
LogP4.16
Rot. Bonds2

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

2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one (PubChem CID 2888388) has the molecular formula C20H16N2O2 and a molecular weight of 316.36 g/mol. Its IUPAC name is 2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one.

Molecular Properties

Compound Name2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one
PubChem CID2888388
Molecular FormulaC20H16N2O2
Molecular Weight316.36 g/mol
Exact Mass316.12
IUPAC Name2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one
SMILESO=C1c2ccccc2NC(c2cccc(O)c2)N1c1ccccc1
InChIInChI=1S/C20H16N2O2/c23-16-10-6-7-14(13-16)19-21-18-12-5-4-11-17(18)20(24)22(19)15-8-2-1-3-9-15/h1-13,19,21,23H
InChIKeyVKEATZROJSMVBC-UHFFFAOYSA-N
XLogP4.16
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one?
The IUPAC name of 2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one (CID 2888388) is 2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one.
What is the SMILES notation for 2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one?
The canonical SMILES for 2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one is O=C1c2ccccc2NC(c2cccc(O)c2)N1c1ccccc1.
What is the InChIKey of 2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one?
The InChIKey is VKEATZROJSMVBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2/c23-16-10-6-7-14(13-16)19-21-18-12-5-4-11-17(18)20(24)22(19)15-8-2-1-3-9-15/h1-13,19,21,23H.
What are the key properties of 2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one?
2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one has a molecular weight of 316.36 g/mol, XLogP of 4.16, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyphenyl)-3-phenyl-1,2-dihydroquinazolin-4-one is sourced from PubChem (CID 2888388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).