Basic information
- Standard SMILES
COc1cc(OC)c(Cl)c(-c2ccc(C(=O)Nc3ccc(CN4CCN(C)CC4)cn3)c3nccnc23)c1Cl- InChIKey
ZSKIUSPECDZDLN-UHFFFAOYSA-N- Molecular formula
- C28H28Cl2N6O3
- Average molar mass
- 567.5 g/mol
Names & identifiers
- Preferred name
- 8-(2,6-Dichloro-3,5-dimethoxy-phenyl)-quinoxaline-5-carboxylic acid [5-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amide
- IUPAC
- 8-(2,6-dichloro-3,5-dimethoxyphenyl)-N-[5-[(4-methylpiperazin-1-yl)methyl]-2-pyridinyl]quinoxaline-5-carboxamide
Names & synonyms
SCHEMBL1126184CHEMBL3653100ZSKIUSPECDZDLN-UHFFFAOYSA-NBDBM102512US8536175, 318-(2,6-Dichloro-3,5-dimethoxy-phenyl)-quinoxaline-5-carboxylic acid [5-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amide8-(2,6-Dichloro-3,5-dimethoxy-phenyl)-quinoxaline-5-carboxylic acid [5-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]amide
Database identifiers
- PubChem CID
- 44514746
- ChEMBL
CHEMBL3653100
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 92.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 789
Related reactions
39 records
Compound notes
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