3-Butyryl-4-(2,4-dichlorophenylamino)-8-methylquinoline

HCID 10248751
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Basic information

Standard SMILES
CCCC(=O)c1cnc2c(C)cccc2c1Nc1ccc(Cl)cc1Cl
InChIKey
HWXNTMGYUMUZRZ-UHFFFAOYSA-N
Molecular formula
C20H18Cl2N2O
Average molar mass
373.3 g/mol
Monoisotopic mass
372.0796186

Names & identifiers

Preferred name
3-Butyryl-4-(2,4-dichlorophenylamino)-8-methylquinoline
IUPAC
1-[4-(2,4-dichloroanilino)-8-methylquinolin-3-yl]butan-1-one

Names & synonyms

CHEMBL96736SCHEMBL10499007HWXNTMGYUMUZRZ-UHFFFAOYSA-N3-butyryl-4-(2,4-dichlorophenylamino)-8-methylquinoline

Database identifiers

PubChem CID
10248751
ChEMBL
CHEMBL96736

Properties

Computed structural properties

XLogP
6.4
Topological polar surface area
42 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
25

Related reactions

3 records
New reaction record

Compound notes

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