Basic information
- Standard SMILES
CC(C)(C)OC(=O)c1ccc(-n2c3ccccc3c3c(-c4ccc(C#N)nc4)cccc32)cc1NCCF- InChIKey
MWMPHHLRTDTGCW-UHFFFAOYSA-N- Molecular formula
- C31H27FN4O2
- Average molar mass
- 506.6 g/mol
Names & identifiers
- Preferred name
- 2-methylpropan-2-yl 4-[4-(6-cyanopyridin-3-yl)-9H-carbazol-9-yl]-2-[(2-fluoroethyl)amino]benzoate
- IUPAC
- tert-butyl 4-[4-(6-cyano-3-pyridinyl)carbazol-9-yl]-2-(2-fluoroethylamino)benzoate
Names & synonyms
SCHEMBL2183331MWMPHHLRTDTGCW-UHFFFAOYSA-N2-methylpropan-2-yl 4-[4-(6-cyanopyridin-3-yl)-9H-carbazol-9-yl]-2-[(2-fluoroethyl)amino]benzoate
Database identifiers
- PubChem CID
- 86655166
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 79.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 868
Related reactions
3 records
Compound notes
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