Basic information
- Standard SMILES
Cc1cscc1-c1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)cn2)c2nccnc12- InChIKey
ZQHHRYXXNKXDBF-UHFFFAOYSA-N- Molecular formula
- C25H26N6OS
- Average molar mass
- 458.6 g/mol
Names & identifiers
- Preferred name
- 8-(4-Methyl-thiophen-3-yl)-quinoxaline-5-carboxylic acid [5-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amide
- IUPAC
- N-[5-[(4-methylpiperazin-1-yl)methyl]-2-pyridinyl]-8-(4-methylthiophen-3-yl)quinoxaline-5-carboxamide
Names & synonyms
SCHEMBL1126736ZQHHRYXXNKXDBF-UHFFFAOYSA-N8-(4-Methyl-thiophen-3-yl)-quinoxaline-5-carboxylic acid [5-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amide
Database identifiers
- PubChem CID
- 44516282
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 659
Related reactions
5 records
Compound notes
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