7-bromo-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one

C65H48Br2N16O5 — CID 157350648

About 7-bromo-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one

7-bromo-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one (PubChem CID 157350648) has the molecular formula C65H48Br2N16O5 and a molecular weight of 1293.01 g/mol. Its IUPAC name is 7-bromo-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one.

Molecular Properties

• Compound Name: 7-bromo-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one
• PubChem CID: 157350648
• Molecular Formula: C65H48Br2N16O5
• Molecular Weight: 1293.01 g/mol
• Exact Mass: 1290.24
• IUPAC Name: 7-bromo-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one
• SMILES: Cc1cc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)ccn1.Cc1ccc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)cn1.Cc1ccc2c(c1)ncc1c(=O)n(-c3ccnc(C)c3)[nH]c12.O=c1c2cnc3cc(CO)ccc3c2[nH]n1-c1ccccn1
• InChI: InChI=1S/C17H14N4O.2C16H11BrN4O.C16H12N4O2/c1-10-3-4-13-15(7-10)19-9-14-16(13)20-21(17(14)22)12-5-6-18-11(2)8-12;1-9-2-4-11(7-18-9)21-16(22)13-8-19-14-6-10(17)3-5-12(14)15(13)20-21;1-9-6-11(4-5-18-9)21-16(22)13-8-19-14-7-10(17)2-3-12(14)15(13)20-21;21-9-10-4-5-11-13(7-10)18-8-12-15(11)19-20(16(12)22)14-3-1-2-6-17-14/h3-9,20H,1-2H3;2*2-8,20H,1H3;1-8,19,21H,9H2
• InChIKey: PYTALNRZPCIEQM-UHFFFAOYSA-N
• XLogP: 11.30
• TPSA: 274.51 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 17
• Rotatable Bonds: 5
• Heavy Atoms: 88
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1293.01
LogP ≤ 5	11.30
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	17

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-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one?

The IUPAC name of 7-bromo-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one (CID 157350648) is 7-bromo-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one.

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

The canonical SMILES for 7-bromo-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one is Cc1cc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)ccn1.Cc1ccc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)cn1.Cc1ccc2c(c1)ncc1c(=O)n(-c3ccnc(C)c3)[nH]c12.O=c1c2cnc3cc(CO)ccc3c2[nH]n1-c1ccccn1.

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

The InChIKey is PYTALNRZPCIEQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O.2C16H11BrN4O.C16H12N4O2/c1-10-3-4-13-15(7-10)19-9-14-16(13)20-21(17(14)22)12-5-6-18-11(2)8-12;1-9-2-4-11(7-18-9)21-16(22)13-8-19-14-6-10(17)3-5-12(14)15(13)20-21;1-9-6-11(4-5-18-9)21-16(22)13-8-19-14-7-10(17)2-3-12(14)15(13)20-21;21-9-10-4-5-11-13(7-10)18-8-12-15(11)19-20(16(12)22)14-3-1-2-6-17-14/h3-9,20H,1-2H3;2*2-8,20H,1H3;1-8,19,21H,9H2.

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

7-bromo-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one has a molecular weight of 1293.01 g/mol, XLogP of 11.30, 5 rotatable bonds, 5 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 7-bromo-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one is sourced from PubChem (CID 157350648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).