2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one

C20H13Cl2N3O — CID 1366169

IUPAC2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one
SMILESCc1cccc(-n2c(-c3ccc(Cl)cc3Cl)nc3ccccc3c2=O)n1
InChIInChI=1S/C20H13Cl2N3O/c1-12-5-4-8-18(23-12)25-19(14-10-9-13(21)11-16(14)22)24-17-7-3-2-6-15(17)20(25)26/h2-11H,1H3
InChIKeyRMONRTSEABTKLE-UHFFFAOYSA-N
MW382.25 g/mol
LogP5.06
Rot. Bonds2

About 2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one

2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one (PubChem CID 1366169) has the molecular formula C20H13Cl2N3O and a molecular weight of 382.25 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one
PubChem CID1366169
Molecular FormulaC20H13Cl2N3O
Molecular Weight382.25 g/mol
Exact Mass381.04
IUPAC Name2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one
SMILESCc1cccc(-n2c(-c3ccc(Cl)cc3Cl)nc3ccccc3c2=O)n1
InChIInChI=1S/C20H13Cl2N3O/c1-12-5-4-8-18(23-12)25-19(14-10-9-13(21)11-16(14)22)24-17-7-3-2-6-15(17)20(25)26/h2-11H,1H3
InChIKeyRMONRTSEABTKLE-UHFFFAOYSA-N
XLogP5.06
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.25
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one with MolForge

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

Launch Full Analysis

Related Compounds

2-(4-methylphenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one
CID 829438
2-[(1S)-1-[3-(6-methyl-2-pyridinyl)-4-oxoquinazolin-2-yl]propyl]isoindole-1,3-dione
CID 94589126
2-(2-chlorophenyl)-3-(2-hydroxyphenyl)quinazolin-4-one
CID 716325
2-(2,4-dichlorophenyl)-3-[2-[2-(4-methylphenoxy)ethoxy]ethyl]quinazolin-4-one
CID 2298240
2-(2,4-dichlorophenyl)-3-[2-[2-(2-methoxyphenoxy)ethoxy]ethyl]quinazolin-4-one
CID 2299298
2-(2,4-dichlorophenyl)-3-methyl-N-(6-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 3498763
5-chloro-3-(2,4-dichlorophenyl)-[1,2,4]triazolo[4,3-c]quinazoline
CID 4204979
3-(3-chlorophenyl)-2-(diethylamino)quinazolin-4-one
CID 10758630
3-(6-methyl-2-pyridinyl)-2-(2-oxooxolan-3-yl)sulfanylquinazolin-4-one
CID 17425100
2-(2,4-dichlorophenyl)-9-oxo-1H-pyrazolo[5,1-b]quinazoline-3-carbaldehyde
CID 135383107
2-(2,4-dichlorophenyl)-1-(naphthalen-1-ylmethyl)benzimidazole
CID 16987710
2-(4-bromo-2-chlorophenyl)-7-chloro-3-(3-fluoro-4-methylphenyl)quinazolin-4-one
CID 11712674

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one?
The IUPAC name of 2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one (CID 1366169) is 2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one?
The canonical SMILES for 2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one is Cc1cccc(-n2c(-c3ccc(Cl)cc3Cl)nc3ccccc3c2=O)n1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one?
The InChIKey is RMONRTSEABTKLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13Cl2N3O/c1-12-5-4-8-18(23-12)25-19(14-10-9-13(21)11-16(14)22)24-17-7-3-2-6-15(17)20(25)26/h2-11H,1H3.
What are the key properties of 2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one?
2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one has a molecular weight of 382.25 g/mol, XLogP of 5.06, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-3-(6-methyl-2-pyridinyl)quinazolin-4-one is sourced from PubChem (CID 1366169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).