7-phenyl-1H-quinazoline-2,4-dione

C14H10N2O2 — CID 118641028

IUPAC7-phenyl-1H-quinazoline-2,4-dione
SMILESO=c1[nH]c(=O)c2ccc(-c3ccccc3)cc2[nH]1
InChIInChI=1S/C14H10N2O2/c17-13-11-7-6-10(9-4-2-1-3-5-9)8-12(11)15-14(18)16-13/h1-8H,(H2,15,16,17,18)
InChIKeyHAOJWCGUAIHQLD-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.88
Rot. Bonds1

About 7-phenyl-1H-quinazoline-2,4-dione

7-phenyl-1H-quinazoline-2,4-dione (PubChem CID 118641028) has the molecular formula C14H10N2O2 and a molecular weight of 238.25 g/mol. Its IUPAC name is 7-phenyl-1H-quinazoline-2,4-dione.

Molecular Properties

Compound Name7-phenyl-1H-quinazoline-2,4-dione
PubChem CID118641028
Molecular FormulaC14H10N2O2
Molecular Weight238.25 g/mol
Exact Mass238.07
IUPAC Name7-phenyl-1H-quinazoline-2,4-dione
SMILESO=c1[nH]c(=O)c2ccc(-c3ccccc3)cc2[nH]1
InChIInChI=1S/C14H10N2O2/c17-13-11-7-6-10(9-4-2-1-3-5-9)8-12(11)15-14(18)16-13/h1-8H,(H2,15,16,17,18)
InChIKeyHAOJWCGUAIHQLD-UHFFFAOYSA-N
XLogP1.88
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-phenyl-1H-quinazoline-2,4-dione?
The IUPAC name of 7-phenyl-1H-quinazoline-2,4-dione (CID 118641028) is 7-phenyl-1H-quinazoline-2,4-dione.
What is the SMILES notation for 7-phenyl-1H-quinazoline-2,4-dione?
The canonical SMILES for 7-phenyl-1H-quinazoline-2,4-dione is O=c1[nH]c(=O)c2ccc(-c3ccccc3)cc2[nH]1.
What is the InChIKey of 7-phenyl-1H-quinazoline-2,4-dione?
The InChIKey is HAOJWCGUAIHQLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O2/c17-13-11-7-6-10(9-4-2-1-3-5-9)8-12(11)15-14(18)16-13/h1-8H,(H2,15,16,17,18).
What are the key properties of 7-phenyl-1H-quinazoline-2,4-dione?
7-phenyl-1H-quinazoline-2,4-dione has a molecular weight of 238.25 g/mol, XLogP of 1.88, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-1H-quinazoline-2,4-dione is sourced from PubChem (CID 118641028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).