4-[(3-Methoxyphenyl)amino]-8-methyl-6-[[3-[[4-(5-oxopentyl)phenyl]carbamoyl]phenyl]sulfonyl]quinoline-3-carboxamide

HCID 58505243
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Basic information

Standard SMILES
COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(S(=O)(=O)c4cccc(C(=O)Nc5ccc(CCCCC=O)cc5)c4)cc23)c1
InChIKey
CUWDGHPSQXEHDP-UHFFFAOYSA-N
Molecular formula
C36H34N4O6S
Average molar mass
650.7 g/mol

Names & identifiers

Preferred name
4-[(3-Methoxyphenyl)amino]-8-methyl-6-[[3-[[4-(5-oxopentyl)phenyl]carbamoyl]phenyl]sulfonyl]quinoline-3-carboxamide
IUPAC
4-(3-methoxyanilino)-8-methyl-6-[3-[[4-(5-oxopentyl)phenyl]carbamoyl]phenyl]sulfonylquinoline-3-carboxamide

Names & synonyms

SCHEMBL1312521CUWDGHPSQXEHDP-UHFFFAOYSA-N4-[(3-Methoxyphenyl)amino]-8-methyl-6-[[3-[[4-(5-oxopentyl)phenyl]carbamoyl]phenyl]sulfonyl]quinoline-3-carboxamide

Database identifiers

PubChem CID
58505243

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
166 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
13
Heavy atoms
47

Related reactions

2 records
New reaction record

Compound notes

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