7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one

C87H66BrCl2N15O6 — CID 159206361

About 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one

7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one (PubChem CID 159206361) has the molecular formula C87H66BrCl2N15O6 and a molecular weight of 1568.39 g/mol. Its IUPAC name is 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one.

Molecular Properties

• Compound Name: 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
• PubChem CID: 159206361
• Molecular Formula: C87H66BrCl2N15O6
• Molecular Weight: 1568.39 g/mol
• Exact Mass: 1565.39
• IUPAC Name: 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
• SMILES: Cc1ccc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4cc(C)ccc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4cc(CO)ccc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4ccc(Cl)cc43)c2=O)cc1.Cc1cccc(-n2[nH]c3c(cnc4ccc(Cl)cc43)c2=O)c1
• InChI: InChI=1S/C18H15N3O2.C18H15N3O.C17H12BrN3O.2C17H12ClN3O/c1-11-2-5-13(6-3-11)21-18(23)15-9-19-16-8-12(10-22)4-7-14(16)17(15)20-21;1-11-3-6-13(7-4-11)21-18(22)15-10-19-16-9-12(2)5-8-14(16)17(15)20-21;1-10-2-5-12(6-3-10)21-17(22)14-9-19-15-8-11(18)4-7-13(15)16(14)20-21;1-10-2-5-12(6-3-10)21-17(22)14-9-19-15-7-4-11(18)8-13(15)16(14)20-21;1-10-3-2-4-12(7-10)21-17(22)14-9-19-15-6-5-11(18)8-13(15)16(14)20-21/h2-9,20,22H,10H2,1H3;3-10,20H,1-2H3;3*2-9,20H,1H3
• InChIKey: GSDJZQXGPQWIRW-UHFFFAOYSA-N
• XLogP: 17.75
• TPSA: 273.63 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 16
• Rotatable Bonds: 6
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1568.39
LogP ≤ 5	17.75
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het_65_B(7)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?

The IUPAC name of 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one (CID 159206361) is 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one.

What is the SMILES notation for 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?

The canonical SMILES for 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one is Cc1ccc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4cc(C)ccc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4cc(CO)ccc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4ccc(Cl)cc43)c2=O)cc1.Cc1cccc(-n2[nH]c3c(cnc4ccc(Cl)cc43)c2=O)c1.

What is the InChIKey of 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?

The InChIKey is GSDJZQXGPQWIRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2.C18H15N3O.C17H12BrN3O.2C17H12ClN3O/c1-11-2-5-13(6-3-11)21-18(23)15-9-19-16-8-12(10-22)4-7-14(16)17(15)20-21;1-11-3-6-13(7-4-11)21-18(22)15-10-19-16-9-12(2)5-8-14(16)17(15)20-21;1-10-2-5-12(6-3-10)21-17(22)14-9-19-15-8-11(18)4-7-13(15)16(14)20-21;1-10-2-5-12(6-3-10)21-17(22)14-9-19-15-7-4-11(18)8-13(15)16(14)20-21;1-10-3-2-4-12(7-10)21-17(22)14-9-19-15-6-5-11(18)8-13(15)16(14)20-21/h2-9,20,22H,10H2,1H3;3-10,20H,1-2H3;3*2-9,20H,1H3.

What are the key properties of 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?

7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one has a molecular weight of 1568.39 g/mol, XLogP of 17.75, 6 rotatable bonds, 6 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 7-bromo-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one is sourced from PubChem (CID 159206361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).