3-(1-{[7-methyl-4-oxo-1-(tetrahydro-2H-pyran-4-yl)-4,5-dihydro-1H-pyrazolo[4,3-c]quinolin-8-yl]carbonyl}piperidin-4-yl)benzoic acid

HCID 136336863
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Basic information

Standard SMILES
Cc1cc2[nH]c(=O)c3cnn(C4CCOCC4)c3c2cc1C(=O)N1CCC(c2cccc(C(=O)O)c2)CC1
InChIKey
MKNMULGZTHKHAF-UHFFFAOYSA-N
Molecular formula
C29H30N4O5
Average molar mass
514.6 g/mol

Names & identifiers

Preferred name
3-(1-{[7-methyl-4-oxo-1-(tetrahydro-2H-pyran-4-yl)-4,5-dihydro-1H-pyrazolo[4,3-c]quinolin-8-yl]carbonyl}piperidin-4-yl)benzoic acid
IUPAC
3-[1-[7-methyl-1-(oxan-4-yl)-4-oxo-5H-pyrazolo[4,5-c]quinoline-8-carbonyl]piperidin-4-yl]benzoic acid

Names & synonyms

SCHEMBL15103205MKNMULGZTHKHAF-UHFFFAOYSA-N3-(1-{[7-methyl-4-oxo-1-(tetrahydro-2H-pyran-4-yl)-4,5-dihydro-1H-pyrazolo[4,3-c]quinolin-8-yl]carbonyl}piperidin-4-yl)benzoic acid

Database identifiers

PubChem CID
136336863

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
114 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
38

Related reactions

1 records
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Linked notes

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