Basic information
- Standard SMILES
CC(=O)Nc1nc2c(Oc3cc(-c4ccc(C(F)(F)F)cc4NC(C)=O)ncn3)cccc2s1- InChIKey
RIKXPYRSCHZKBC-UHFFFAOYSA-N- Molecular formula
- C22H16F3N5O3S
- Average molar mass
- 487.5 g/mol
Names & identifiers
- Preferred name
- N-{2-[6-(2-Acetylamino-benzothiazol-4-yloxy)-pyrimidin-4-yl]-5-trifluoromethyl-phenyl}-acetamide
- IUPAC
- N-[2-[6-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]pyrimidin-4-yl]-5-(trifluoromethyl)phenyl]acetamide
Names & synonyms
N-{2-[6-(2-Acetylamino-benzothiazol-4-yloxy)-pyrimidin-4-yl]-5-trifluoromethyl-phenyl}-acetamideSCHEMBL1039725
Database identifiers
- PubChem CID
- 21865237
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 745
Related reactions
2 records
Compound notes
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