N-(4-{2-[4-(1H-indazol-3-yl)-piperazin-1-yl]-ethyl}-2-methyl-phenyl)-N-methyl-acetamide

HCID 21963371
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Basic information

Standard SMILES
CC(=O)N(C)c1ccc(CCN2CCN(c3n[nH]c4ccccc34)CC2)cc1C
InChIKey
KRICUTDQSPASCK-UHFFFAOYSA-N
Molecular formula
C23H29N5O
Average molar mass
391.5 g/mol

Names & identifiers

Preferred name
N-(4-{2-[4-(1H-indazol-3-yl)-piperazin-1-yl]-ethyl}-2-methyl-phenyl)-N-methyl-acetamide
IUPAC
N-[4-[2-[4-(1H-indazol-3-yl)piperazin-1-yl]ethyl]-2-methylphenyl]-N-methylacetamide

Names & synonyms

SCHEMBL6108032KRICUTDQSPASCK-UHFFFAOYSA-NN-(4-{2-[4-(1H-indazol-3-yl)-piperazin-1-yl]-ethyl}-2-methyl-phenyl)-N-methyl-acetamide

Database identifiers

PubChem CID
21963371

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
55.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
29

Related reactions

1 records
New reaction record

Compound notes

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