3-(9-chloro-3-methyl-4-oxo-5H-isoxazolo[4,3-c]quinolin-5-yl)-piperidine-1-carboxylic acid methyl ester

HCID 9951561
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Basic information

Standard SMILES
COC(=O)N1CCCC(n2c(=O)c3c(C)onc3c3c(Cl)cccc32)C1
InChIKey
ZUGKFPPQDQHDHX-UHFFFAOYSA-N
Molecular formula
C18H18ClN3O4
Average molar mass
375.8 g/mol
Monoisotopic mass
375.0985838

Names & identifiers

Preferred name
3-(9-chloro-3-methyl-4-oxo-5H-isoxazolo[4,3-c]quinolin-5-yl)-piperidine-1-carboxylic acid methyl ester
IUPAC
methyl 3-(9-chloro-3-methyl-4-oxo-[1,2]oxazolo[4,3-c]quinolin-5-yl)piperidine-1-carboxylate

Names & synonyms

SCHEMBL6067872ZUGKFPPQDQHDHX-UHFFFAOYSA-N3 -(9-chloro-3-methyl-4-oxo-5H-isoxazolo[4,3-c]quinolin-5-yl)-piperidine-1-carboxylic acid methyl ester3-(9-chloro-3-methyl-4-oxo-5H-isoxazolo[4,3-c]quinolin-5-yl)-piperidine-1-carboxylic acid methyl ester

Database identifiers

PubChem CID
9951561

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
75.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
26

Related reactions

2 records
New reaction record

Linked notes

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