N-[4-chloro-3-(trifluoromethyl)phenyl]-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide
Chemical Structure Depiction of
N-[4-chloro-3-(trifluoromethyl)phenyl]-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide
N-[4-chloro-3-(trifluoromethyl)phenyl]-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide
Compound characteristics
| Compound ID: | Y043-7332 |
| Compound Name: | N-[4-chloro-3-(trifluoromethyl)phenyl]-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide |
| Molecular Weight: | 427.83 |
| Molecular Formula: | C15 H17 Cl F3 N3 O4 S |
| Smiles: | C[C@@H](C(Nc1ccc(c(c1)C(F)(F)F)[Cl])=O)NC(NC1CCS(C1)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.786 |
| logD: | 1.7596 |
| logSw: | -3.0935 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.874 |
| InChI Key: | MWRPQIUFVIWUKN-PEHGTWAWSA-N |