2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one

C18H14ClN3O — CID 90681347

IUPAC2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one
SMILESCc1ccc2c(=O)n(C)c3cc(-c4ccc(Cl)cc4)nn3c2c1
InChIInChI=1S/C18H14ClN3O/c1-11-3-8-14-16(9-11)22-17(21(2)18(14)23)10-15(20-22)12-4-6-13(19)7-5-12/h3-10H,1-2H3
InChIKeyIJMLBBAIAZEXPL-UHFFFAOYSA-N
MW323.78 g/mol
LogP3.82
Rot. Bonds1

About 2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one

2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one (PubChem CID 90681347) has the molecular formula C18H14ClN3O and a molecular weight of 323.78 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one.

Molecular Properties

Compound Name2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one
PubChem CID90681347
Molecular FormulaC18H14ClN3O
Molecular Weight323.78 g/mol
Exact Mass323.08
IUPAC Name2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one
SMILESCc1ccc2c(=O)n(C)c3cc(-c4ccc(Cl)cc4)nn3c2c1
InChIInChI=1S/C18H14ClN3O/c1-11-3-8-14-16(9-11)22-17(21(2)18(14)23)10-15(20-22)12-4-6-13(19)7-5-12/h3-10H,1-2H3
InChIKeyIJMLBBAIAZEXPL-UHFFFAOYSA-N
XLogP3.82
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.78
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-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-phenylpyrazolo[1,5-a]quinazolin-5(4H)-one
CID 135939584
2-(3-chlorophenyl)pyrazolo[1,5-a]quinazolin-5(4H)-one
CID 135939590
6-chloro-9-hydroxy-3-methyl-1-phenyl-1H,4H,9H-pyrazolo[3,4-b]quinolin-4-one
CID 23647236
1-(3-Chlorophenyl)-3,5-dimethylpyrazolo[4,5-c]quinolin-4-one
CID 2785498
[3-[5-Amino-3-(4-chlorophenyl)pyrazol-1-yl]phenyl]-(3,3-dimethylpiperidin-1-yl)methanone
CID 44526666
2-(3-Chlorophenyl)-4-methyl-8-pyridin-3-ylpyrazolo[1,5-a]quinazolin-5-one
CID 90643964
3-[2-(4-Chlorophenyl)-4-methyl-5-oxopyrazolo[1,5-a]quinazolin-8-yl]benzenesulfonamide
CID 90643970
2-(4-Chlorophenyl)-4-methyl-8-pyridin-3-ylpyrazolo[1,5-a]quinazolin-5-one
CID 90643971
2-p-tolylpyrazolo[1,5-a]quinazolin-5(4H)-one
CID 135907000
2-(4-ethylphenyl)pyrazolo[1,5-a]quinazolin-5(4H)-one
CID 135907001
2-(4-chlorophenyl)pyrazolo[1,5-a]quinazolin-5(4H)-one
CID 136123474
2-methyl-4-(4-methylbenzyl)pyrazolo[1,5-a]quinazolin-5(4H)-one
CID 1481841

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one?
The IUPAC name of 2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one (CID 90681347) is 2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one.
What is the SMILES notation for 2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one?
The canonical SMILES for 2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one is Cc1ccc2c(=O)n(C)c3cc(-c4ccc(Cl)cc4)nn3c2c1.
What is the InChIKey of 2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one?
The InChIKey is IJMLBBAIAZEXPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN3O/c1-11-3-8-14-16(9-11)22-17(21(2)18(14)23)10-15(20-22)12-4-6-13(19)7-5-12/h3-10H,1-2H3.
What are the key properties of 2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one?
2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one has a molecular weight of 323.78 g/mol, XLogP of 3.82, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-4,8-dimethylpyrazolo[1,5-a]quinazolin-5-one is sourced from PubChem (CID 90681347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).