5,7-dihydroxy-3-phenylquinazolin-4-one

C14H10N2O3 — CID 11579722

IUPAC5,7-dihydroxy-3-phenylquinazolin-4-one
SMILESO=c1c2c(O)cc(O)cc2ncn1-c1ccccc1
InChIInChI=1S/C14H10N2O3/c17-10-6-11-13(12(18)7-10)14(19)16(8-15-11)9-4-2-1-3-5-9/h1-8,17-18H
InChIKeyLUBZIRZXRMLBKH-UHFFFAOYSA-N
MW254.25 g/mol
LogP1.80
Rot. Bonds1

About 5,7-dihydroxy-3-phenylquinazolin-4-one

5,7-dihydroxy-3-phenylquinazolin-4-one (PubChem CID 11579722) has the molecular formula C14H10N2O3 and a molecular weight of 254.25 g/mol. Its IUPAC name is 5,7-dihydroxy-3-phenylquinazolin-4-one.

Molecular Properties

Compound Name5,7-dihydroxy-3-phenylquinazolin-4-one
PubChem CID11579722
Molecular FormulaC14H10N2O3
Molecular Weight254.25 g/mol
Exact Mass254.07
IUPAC Name5,7-dihydroxy-3-phenylquinazolin-4-one
SMILESO=c1c2c(O)cc(O)cc2ncn1-c1ccccc1
InChIInChI=1S/C14H10N2O3/c17-10-6-11-13(12(18)7-10)14(19)16(8-15-11)9-4-2-1-3-5-9/h1-8,17-18H
InChIKeyLUBZIRZXRMLBKH-UHFFFAOYSA-N
XLogP1.80
TPSA75.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5,7-dihydroxy-3-phenylquinazolin-4-one?
The IUPAC name of 5,7-dihydroxy-3-phenylquinazolin-4-one (CID 11579722) is 5,7-dihydroxy-3-phenylquinazolin-4-one.
What is the SMILES notation for 5,7-dihydroxy-3-phenylquinazolin-4-one?
The canonical SMILES for 5,7-dihydroxy-3-phenylquinazolin-4-one is O=c1c2c(O)cc(O)cc2ncn1-c1ccccc1.
What is the InChIKey of 5,7-dihydroxy-3-phenylquinazolin-4-one?
The InChIKey is LUBZIRZXRMLBKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O3/c17-10-6-11-13(12(18)7-10)14(19)16(8-15-11)9-4-2-1-3-5-9/h1-8,17-18H.
What are the key properties of 5,7-dihydroxy-3-phenylquinazolin-4-one?
5,7-dihydroxy-3-phenylquinazolin-4-one has a molecular weight of 254.25 g/mol, XLogP of 1.80, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dihydroxy-3-phenylquinazolin-4-one is sourced from PubChem (CID 11579722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).