7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one

C88H69Br2N15O6 — CID 160791337

About 7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one

7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one (PubChem CID 160791337) has the molecular formula C88H69Br2N15O6 and a molecular weight of 1592.43 g/mol. Its IUPAC name is 7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one.

Molecular Properties

• Compound Name: 7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one
• PubChem CID: 160791337
• Molecular Formula: C88H69Br2N15O6
• Molecular Weight: 1592.43 g/mol
• Exact Mass: 1589.39
• IUPAC Name: 7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one
• SMILES: Cc1ccc(-n2[nH]c3c(cnc4c(C)c(CO)ccc43)c2=O)cc1.Cc1ccc2c(c1)ncc1c(=O)n(-c3ccccc3)[nH]c12.Cc1ccc2ncc3c(=O)n(-c4ccccc4C)[nH]c3c2c1.Cc1cccc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)c1.Cc1ccccc1-n1[nH]c2c(cnc3cc(Br)ccc32)c1=O
• InChI: InChI=1S/C19H17N3O2.C18H15N3O.2C17H12BrN3O.C17H13N3O/c1-11-3-6-14(7-4-11)22-19(24)16-9-20-17-12(2)13(10-23)5-8-15(17)18(16)21-22;1-11-7-8-15-13(9-11)17-14(10-19-15)18(22)21(20-17)16-6-4-3-5-12(16)2;1-10-3-2-4-12(7-10)21-17(22)14-9-19-15-8-11(18)5-6-13(15)16(14)20-21;1-10-4-2-3-5-15(10)21-17(22)13-9-19-14-8-11(18)6-7-12(14)16(13)20-21;1-11-7-8-13-15(9-11)18-10-14-16(13)19-20(17(14)21)12-5-3-2-4-6-12/h3-9,21,23H,10H2,1-2H3;3-10,20H,1-2H3;2*2-9,20H,1H3;2-10,19H,1H3
• InChIKey: UYBVTLWIHTXLIY-UHFFFAOYSA-N
• XLogP: 17.51
• 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	1592.43
LogP ≤ 5	17.51
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-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one?

The IUPAC name of 7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one (CID 160791337) is 7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one.

What is the SMILES notation for 7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one?

The canonical SMILES for 7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one is Cc1ccc(-n2[nH]c3c(cnc4c(C)c(CO)ccc43)c2=O)cc1.Cc1ccc2c(c1)ncc1c(=O)n(-c3ccccc3)[nH]c12.Cc1ccc2ncc3c(=O)n(-c4ccccc4C)[nH]c3c2c1.Cc1cccc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)c1.Cc1ccccc1-n1[nH]c2c(cnc3cc(Br)ccc32)c1=O.

What is the InChIKey of 7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one?

The InChIKey is UYBVTLWIHTXLIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2.C18H15N3O.2C17H12BrN3O.C17H13N3O/c1-11-3-6-14(7-4-11)22-19(24)16-9-20-17-12(2)13(10-23)5-8-15(17)18(16)21-22;1-11-7-8-15-13(9-11)17-14(10-19-15)18(22)21(20-17)16-6-4-3-5-12(16)2;1-10-3-2-4-12(7-10)21-17(22)14-9-19-15-8-11(18)5-6-13(15)16(14)20-21;1-10-4-2-3-5-15(10)21-17(22)13-9-19-14-8-11(18)6-7-12(14)16(13)20-21;1-11-7-8-13-15(9-11)18-10-14-16(13)19-20(17(14)21)12-5-3-2-4-6-12/h3-9,21,23H,10H2,1-2H3;3-10,20H,1-2H3;2*2-9,20H,1H3;2-10,19H,1H3.

What are the key properties of 7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one?

7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one has a molecular weight of 1592.43 g/mol, XLogP of 17.51, 6 rotatable bonds, 6 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 7-bromo-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one is sourced from PubChem (CID 160791337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).