Basic information
- Standard SMILES
O=C1Cc2ccc(Nc3ncc(C(F)(F)F)c(Cl)n3)cc2N1- InChIKey
ADWOUUZJYPJUDH-UHFFFAOYSA-N- Molecular formula
- C13H8ClF3N4O
- Average molar mass
- 328.68 g/mol
Names & identifiers
- Preferred name
- 6-(4-Chloro-5-trifluoromethyl-pyrimidin-2-ylamino)-1,3-dihydro-indol-2-one
- IUPAC
- 6-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]amino]-1,3-dihydroindol-2-one
Names & synonyms
6-(4-Chloro-5-trifluoromethyl-pyrimidin-2-ylamino)-1,3-dihydro-indol-2-oneSCHEMBL5198889
Database identifiers
- PubChem CID
- 21868697
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 436
Related reactions
2 records
Compound notes
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