N-(3-chloro-4-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]valinamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]valinamide
N-(3-chloro-4-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]valinamide
Compound characteristics
| Compound ID: | Y043-7307 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]valinamide |
| Molecular Weight: | 405.87 |
| Molecular Formula: | C16 H21 Cl F N3 O4 S |
| Smiles: | CC(C)[C@@H](C(Nc1ccc(c(c1)[Cl])F)=O)NC(NC1CCS(C1)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.4399 |
| logD: | 1.4204 |
| logSw: | -2.6815 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.063 |
| InChI Key: | HQFRTGMPKFHUFM-IAXJKZSUSA-N |