Basic information
- Standard SMILES
CCN1CCN(c2cccc(NC(=O)c3ccc(-c4c(C)cccc4C)c4nccnc34)c2)CC1- InChIKey
OWAHTNZTMRLWAY-UHFFFAOYSA-N- Molecular formula
- C29H31N5O
- Average molar mass
- 465.6 g/mol
Names & identifiers
- Preferred name
- 8-(2,6-Dimethyl-phenyl)-Quinoxaline-5-carboxylic acid [3-(4-ethyl-piperazin-1-yl)phenyl]-amide
- IUPAC
- 8-(2,6-dimethylphenyl)-N-[3-(4-ethylpiperazin-1-yl)phenyl]quinoxaline-5-carboxamide
Names & synonyms
SCHEMBL12678315OWAHTNZTMRLWAY-UHFFFAOYSA-N8-(2,6-Dimethyl-phenyl)-quinoxaline-5-carboxylic acid [3-(4-ethyl-piperazin-1-yl)-phenyl]-amide8-(2,6-Dimethyl-phenyl)-Quinoxaline-5-carboxylic acid [3-(4-ethyl-piperazin-1-yl)phenyl]-amide
Database identifiers
- PubChem CID
- 44516604
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 685
Related reactions
5 records
Compound notes
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