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

C65H48Br2N16O8 — CID 161465301

IUPAC7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one
SMILESCOc1cc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)ccn1.COc1cc(-n2[nH]c3c(cnc4cc(C)ccc43)c2=O)ccn1.COc1ccc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)cn1.O=c1c2cnc3cc(CO)ccc3c2[nH]n1-c1ccccn1
InChIInChI=1S/C17H14N4O2.2C16H11BrN4O2.C16H12N4O2/c1-10-3-4-12-14(7-10)19-9-13-16(12)20-21(17(13)22)11-5-6-18-15(8-11)23-2;1-23-14-5-3-10(7-19-14)21-16(22)12-8-18-13-6-9(17)2-4-11(13)15(12)20-21;1-23-14-7-10(4-5-18-14)21-16(22)12-8-19-13-6-9(17)2-3-11(13)15(12)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
InChIKeyCINLHZOLQZRZJV-UHFFFAOYSA-N
MW1341.01 g/mol
LogP10.40
Rot. Bonds8

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

7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one (PubChem CID 161465301) has the molecular formula C65H48Br2N16O8 and a molecular weight of 1341.01 g/mol. Its IUPAC name is 7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one.

Molecular Properties

Compound Name7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one
PubChem CID161465301
Molecular FormulaC65H48Br2N16O8
Molecular Weight1341.01 g/mol
Exact Mass1338.22
IUPAC Name7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one
SMILESCOc1cc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)ccn1.COc1cc(-n2[nH]c3c(cnc4cc(C)ccc43)c2=O)ccn1.COc1ccc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)cn1.O=c1c2cnc3cc(CO)ccc3c2[nH]n1-c1ccccn1
InChIInChI=1S/C17H14N4O2.2C16H11BrN4O2.C16H12N4O2/c1-10-3-4-12-14(7-10)19-9-13-16(12)20-21(17(13)22)11-5-6-18-15(8-11)23-2;1-23-14-5-3-10(7-19-14)21-16(22)12-8-18-13-6-9(17)2-4-11(13)15(12)20-21;1-23-14-7-10(4-5-18-14)21-16(22)12-8-19-13-6-9(17)2-3-11(13)15(12)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
InChIKeyCINLHZOLQZRZJV-UHFFFAOYSA-N
XLogP10.40
TPSA302.20 Ų
H-Bond Donors5
H-Bond Acceptors20
Rotatable Bonds8
Heavy Atoms91
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001341.01
LogP ≤ 510.40
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

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

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Related Compounds

7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methoxyphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-(hydroxymethyl)-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one
CID 157327962
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
7-bromo-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-pyridin-3-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-pyridin-4-yl-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-pyridin-3-yl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 157493989
7-bromo-2-pyridin-4-yl-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-pyridin-4-yl-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-pyrazin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 157821883
7-bromo-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-pyridin-3-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-pyridin-4-yl-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one
CID 158220233
7-bromo-2-[2-(trideuteriomethoxy)phenyl]-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-[3-(trideuteriomethoxy)phenyl]-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(4-methoxyphenyl)-6-methyl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-[2-(trideuteriomethoxy)phenyl]-1H-pyrazolo[4,3-c]quinolin-3-one
CID 158268778
7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(3-methoxyphenyl)-1H-pyrazolo[4,3-c][1,7]naphthyridin-3-one;7-(hydroxymethyl)-2-pyridin-3-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-4-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(3-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c][1,7]naphthyridin-3-one;2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c][1,7]naphthyridin-3-one
CID 158514291
8-bromo-6-fluoro-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-bromo-6-fluoro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-bromo-6-fluoro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-[3-(trideuteriomethoxy)phenyl]-1H-pyrazolo[4,3-c]quinolin-3-one;2-(3-methoxyphenyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 160666652
8-(4-hydroxypiperidin-1-yl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one;2-(4-methoxyphenyl)-8-(4-methylpiperazin-1-yl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one;2-phenyl-7-piperazin-1-yl-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one
CID 160667531
7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-pyridin-4-yl-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-pyrazin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 161971345
7-bromo-2-(4-methoxyphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-(hydroxymethyl)-2-pyridin-4-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(3-methoxyphenyl)-7-methyl-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;2-(4-methoxyphenyl)-7-methyl-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one
CID 162044169
7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-chloro-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one
CID 162245590

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one?
The IUPAC name of 7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one (CID 161465301) is 7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one.
What is the SMILES notation for 7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one?
The canonical SMILES for 7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one is COc1cc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)ccn1.COc1cc(-n2[nH]c3c(cnc4cc(C)ccc43)c2=O)ccn1.COc1ccc(-n2[nH]c3c(cnc4cc(Br)ccc43)c2=O)cn1.O=c1c2cnc3cc(CO)ccc3c2[nH]n1-c1ccccn1.
What is the InChIKey of 7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one?
The InChIKey is CINLHZOLQZRZJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O2.2C16H11BrN4O2.C16H12N4O2/c1-10-3-4-12-14(7-10)19-9-13-16(12)20-21(17(13)22)11-5-6-18-15(8-11)23-2;1-23-14-5-3-10(7-19-14)21-16(22)12-8-18-13-6-9(17)2-4-11(13)15(12)20-21;1-23-14-7-10(4-5-18-14)21-16(22)12-8-19-13-6-9(17)2-3-11(13)15(12)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-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one?
7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one has a molecular weight of 1341.01 g/mol, XLogP of 10.40, 8 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-bromo-2-(6-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-(hydroxymethyl)-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-(2-methoxy-4-pyridinyl)-7-methyl-1H-pyrazolo[4,3-c]quinolin-3-one is sourced from PubChem (CID 161465301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).