5-[1-(4-Chloro-2-trifluoromethyl-benzyl)-1H-indazol-5-ylmethylene]-2-{methyl-[2-(4-methyl-piperazin-1-yl)-ethyl]-amino}-thiazol-4-one

HCID 67348992
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Basic information

Standard SMILES
CN1CCN(CCN(C)C2=NC(=O)C(=Cc3ccc4c(cnn4Cc4ccc(Cl)cc4C(F)(F)F)c3)S2)CC1
InChIKey
LRNKWQQHFSEVMX-UHFFFAOYSA-N
Molecular formula
C27H28ClF3N6OS
Average molar mass
577.1 g/mol
Monoisotopic mass
576.1685929

Names & identifiers

Preferred name
5-[1-(4-Chloro-2-trifluoromethyl-benzyl)-1H-indazol-5-ylmethylene]-2-{methyl-[2-(4-methyl-piperazin-1-yl)-ethyl]-amino}-thiazol-4-one
IUPAC
5-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]indazol-5-yl]methylidene]-2-[methyl-[2-(4-methylpiperazin-1-yl)ethyl]amino]-1,3-thiazol-4-one

Names & synonyms

5-[1-(4-Chloro-2-trifluoromethyl-benzyl)-1H-indazol-5-ylmethylene]-2-{methyl-[2-(4-methyl-piperazin-1-yl)-ethyl]-amino}-thiazol-4-oneSCHEMBL2286396

Database identifiers

PubChem CID
67348992

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
82.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
39

Related reactions

2 records
New reaction record

Compound notes

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