9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one

C16H10ClN3O — CID 135504150

IUPAC9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one
SMILESO=c1[nH]c2ccc(Cl)cc2c2cc(-c3ccccc3)nn12
InChIInChI=1S/C16H10ClN3O/c17-11-6-7-13-12(8-11)15-9-14(10-4-2-1-3-5-10)19-20(15)16(21)18-13/h1-9H,(H,18,21)
InChIKeyUBKGUGZYPLWURO-UHFFFAOYSA-N
MW295.73 g/mol
LogP3.50
Rot. Bonds1

About 9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one

9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one (PubChem CID 135504150) has the molecular formula C16H10ClN3O and a molecular weight of 295.73 g/mol. Its IUPAC name is 9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one.

Molecular Properties

Compound Name9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one
PubChem CID135504150
Molecular FormulaC16H10ClN3O
Molecular Weight295.73 g/mol
Exact Mass295.05
IUPAC Name9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one
SMILESO=c1[nH]c2ccc(Cl)cc2c2cc(-c3ccccc3)nn12
InChIInChI=1S/C16H10ClN3O/c17-11-6-7-13-12(8-11)15-9-14(10-4-2-1-3-5-10)19-20(15)16(21)18-13/h1-9H,(H,18,21)
InChIKeyUBKGUGZYPLWURO-UHFFFAOYSA-N
XLogP3.50
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.73
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-p-Tolyl-6H-pyrazolo[1,5-c]quinazolin-5-one
CID 135504122
5-(2-Chlorophenyl)-2-methyl-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 652880
1H-Indazole-1-carboxamide, 3-amino-5-chloro-N-(4-(phenylmethyl)phenyl)-
CID 51033073
2-(2-Fluoro-phenyl)-6H-pyrazolo[1,5-c]quinazolin-5-one
CID 135504131
2-(4-Chloro-phenyl)-6H-pyrazolo[1,5-c]quinazolin-5-one
CID 135513694
2-Phenylpyrazolo[1,5-C]quinazolin-5(6H)-one
CID 135536664
5-chloro-N-(2-methylphenyl)-1H-indazole-1-carboxamide
CID 22510510
5-chloro-N-(2-fluorophenyl)-1H-indazole-1-carboxamide
CID 22510699
N-(4-chlorophenyl)-3-phenyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
CID 121442894
5-chloro-N-(2,5-dimethylphenyl)-1H-indazole-1-carboxamide
CID 16016791
2-(4-Chlorophenyl)-5,6-dihydropyrazolo[1,5-c]quinazolin-5-ol
CID 168299896
2-Methylpyrazolo[1,5-c]quinazolin-5(6H)-one
CID 135459438

Frequently Asked Questions

What is the IUPAC name of 9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one?
The IUPAC name of 9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one (CID 135504150) is 9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one.
What is the SMILES notation for 9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one?
The canonical SMILES for 9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one is O=c1[nH]c2ccc(Cl)cc2c2cc(-c3ccccc3)nn12.
What is the InChIKey of 9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one?
The InChIKey is UBKGUGZYPLWURO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClN3O/c17-11-6-7-13-12(8-11)15-9-14(10-4-2-1-3-5-10)19-20(15)16(21)18-13/h1-9H,(H,18,21).
What are the key properties of 9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one?
9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one has a molecular weight of 295.73 g/mol, XLogP of 3.50, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-chloro-2-phenyl-6H-pyrazolo[1,5-c]quinazolin-5-one is sourced from PubChem (CID 135504150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).