Basic information
- Standard SMILES
NS(=O)(=O)Cc1cccc(Nc2ncnc(N3CCC(F)(F)CC3)n2)c1- InChIKey
LJLVORDMTIRUPK-UHFFFAOYSA-N- Molecular formula
- C15H18F2N6O2S
- Average molar mass
- 384.4 g/mol
- Monoisotopic mass
- 384.11800134
Names & identifiers
- Preferred name
- 3-[(4-(4,4-Difluoropiperidin-1-yl)-1,3,5-triazin-2-yl)amino]-benzenemethanesulfonamide
- IUPAC
- [3-[[4-(4,4-difluoropiperidin-1-yl)-1,3,5-triazin-2-yl]amino]phenyl]methanesulfonamide
Names & synonyms
3-[(4-(4,4-Difluoropiperidin-1-yl)-1,3,5-triazin-2-yl)amino]-benzenemethanesulfonamideSCHEMBL12486627
Database identifiers
- PubChem CID
- 60197102
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 563
Related reactions
2 records
Compound notes
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