4-{8-[4-(4-Methyl-piperazin-1-yl)-phenylamino]-[1,2,4]triazolo[1,5-a]pyrazin-5-yl}-thiophene-2-carboxylic acid amide

HCID 57589928

Basic information

Standard SMILES
CN1CCN(c2ccc(Nc3ncc(-c4csc(C(N)=O)c4)n4ncnc34)cc2)CC1
InChIKey
JGGDMMYPOPZHLL-UHFFFAOYSA-N
Molecular formula
C21H22N8OS
Average molar mass
434.5 g/mol

Names & identifiers

Preferred name
4-{8-[4-(4-Methyl-piperazin-1-yl)-phenylamino]-[1,2,4]triazolo[1,5-a]pyrazin-5-yl}-thiophene-2-carboxylic acid amide
IUPAC
4-[8-[4-(4-methylpiperazin-1-yl)anilino]-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]thiophene-2-carboxamide

Names & synonyms

SCHEMBL1476556JGGDMMYPOPZHLL-UHFFFAOYSA-N4-{8-[4-(4-Methyl-piperazin-1-yl)-phenylamino]-[1,2,4]triazolo[1,5-a]pyrazin-5-yl}-thiophene-2-carboxylic acid amide

Database identifiers

PubChem CID
57589928

Properties

Computed structural properties

XLogP
2
Topological polar surface area
133 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
5
Heavy atoms
31

Related reactions

67 records

Compound notes

Loading…