Basic information
- Standard SMILES
CCOc1cc(CCN2CCN(C)CC2)ccc1Nc1nccc(-c2c(-c3ccc(OC)c(C(=O)Nc4c(F)cccc4F)c3)nc3ccccn23)n1- InChIKey
OFWJQFXAEFBAIB-UHFFFAOYSA-N- Molecular formula
- C40H40F2N8O3
- Average molar mass
- 718.8 g/mol
Names & identifiers
- Preferred name
- N-(2,6-difluorophenyl)-5-{3-[2-({2-(ethyloxy)-4-[2-(4-methyl-1-piperazinyl)ethyl]-phenyl}amino)-4-pyrimidinyl]imidazo[1,2-a]pyridin-2-yl}-2-(methyloxy)benzamide
- IUPAC
- N-(2,6-difluorophenyl)-5-[3-[2-[2-ethoxy-4-[2-(4-methylpiperazin-1-yl)ethyl]anilino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]-2-methoxybenzamide
Names & synonyms
SCHEMBL311261OFWJQFXAEFBAIB-UHFFFAOYSA-NN-(2,6-difluorophenyl)-5-{3-[2-({2-(ethyloxy)-4-[2-(4-methyl-1-piperazinyl)ethyl]-phenyl}amino)-4-pyrimidinyl]imidazo[1,2-a]pyridin-2-yl}-2-(methyloxy)benzamide
Database identifiers
- PubChem CID
- 59452807
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 12
- Heavy atoms
- 53
- Formal charge
- 0
- Complexity
- 1,140
Related reactions
2 records
Compound notes
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