4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one

C19H13N3O — CID 134914632

IUPAC4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one
SMILESO=c1nc2nc(-c3ccccc3)ccc2c(-c2ccccc2)[nH]1
InChIInChI=1S/C19H13N3O/c23-19-21-17(14-9-5-2-6-10-14)15-11-12-16(20-18(15)22-19)13-7-3-1-4-8-13/h1-12H,(H,20,21,22,23)
InChIKeyBERQYNBKJJQZPA-UHFFFAOYSA-N
MW299.33 g/mol
LogP3.65
Rot. Bonds2

About 4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one

4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one (PubChem CID 134914632) has the molecular formula C19H13N3O and a molecular weight of 299.33 g/mol. Its IUPAC name is 4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one.

Molecular Properties

Compound Name4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one
PubChem CID134914632
Molecular FormulaC19H13N3O
Molecular Weight299.33 g/mol
Exact Mass299.11
IUPAC Name4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one
SMILESO=c1nc2nc(-c3ccccc3)ccc2c(-c2ccccc2)[nH]1
InChIInChI=1S/C19H13N3O/c23-19-21-17(14-9-5-2-6-10-14)15-11-12-16(20-18(15)22-19)13-7-3-1-4-8-13/h1-12H,(H,20,21,22,23)
InChIKeyBERQYNBKJJQZPA-UHFFFAOYSA-N
XLogP3.65
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one?
The IUPAC name of 4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one (CID 134914632) is 4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one.
What is the SMILES notation for 4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one?
The canonical SMILES for 4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one is O=c1nc2nc(-c3ccccc3)ccc2c(-c2ccccc2)[nH]1.
What is the InChIKey of 4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one?
The InChIKey is BERQYNBKJJQZPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3O/c23-19-21-17(14-9-5-2-6-10-14)15-11-12-16(20-18(15)22-19)13-7-3-1-4-8-13/h1-12H,(H,20,21,22,23).
What are the key properties of 4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one?
4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one has a molecular weight of 299.33 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-2-one is sourced from PubChem (CID 134914632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).