N-(4-bromo-2-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide
N-(4-bromo-2-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide
Compound characteristics
| Compound ID: | Y043-7348 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-N~2~-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]alaninamide |
| Molecular Weight: | 422.27 |
| Molecular Formula: | C14 H17 Br F N3 O4 S |
| Smiles: | C[C@@H](C(Nc1ccc(cc1F)[Br])=O)NC(NC1CCS(C1)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.1579 |
| logD: | 1.1498 |
| logSw: | -2.2505 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.176 |
| InChI Key: | JSWSLTFMGZTZBS-PEHGTWAWSA-N |