N-(3-chloro-4-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide
N-(3-chloro-4-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide
Compound characteristics
| Compound ID: | Y043-7333 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide |
| Molecular Weight: | 377.82 |
| Molecular Formula: | C14 H17 Cl F N3 O4 S |
| Smiles: | C[C@@H](C(Nc1ccc(c(c1)[Cl])F)=O)NC(NC1CCS(C1)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.909 |
| logD: | 0.9009 |
| logSw: | -2.646 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.874 |
| InChI Key: | ULHRREHRSUJBGW-PEHGTWAWSA-N |