Basic information
- Standard SMILES
COCCN1CCN(c2ccc(Nc3nccc(-c4c(-c5cccc(C(=O)Nc6c(F)cccc6F)c5)nc5ccccn45)n3)c(OC)c2)CC1- InChIKey
DUMYPWASWOVLDF-UHFFFAOYSA-N- Molecular formula
- C38H36F2N8O3
- Average molar mass
- 690.7 g/mol
Names & identifiers
- Preferred name
- N-(2,6-difluorophenyl)-3-(3-{2-[(2-(methyloxy)-4-{4-[2-(methyloxy)ethyl]-1-piperazinyl}phenyl)amino]-4-pyrimidinyl}imidazo[1,2-a]pyridin-2-yl)benzamide
- IUPAC
- N-(2,6-difluorophenyl)-3-[3-[2-[2-methoxy-4-[4-(2-methoxyethyl)piperazin-1-yl]anilino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]benzamide
Names & synonyms
SCHEMBL310952CHEMBL3892197DUMYPWASWOVLDF-UHFFFAOYSA-NN-(2,6-difluorophenyl)-3-(3-{2-[(2-(methyloxy)-4-{4-[2-(methyloxy)ethyl]-1-piperazinyl}phenyl)amino]-4-pyrimidinyl}imidazo[1,2-a]pyridin-2-yl)benzamide
Database identifiers
- PubChem CID
- 59452803
- ChEMBL
CHEMBL3892197
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 11
- Heavy atoms
- 51
- Formal charge
- 0
- Complexity
- 1,100
Related reactions
2 records
Compound notes
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