N~2~-[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]-N~2~-(2-fluorophenyl)-N-phenylglycinamide
Chemical Structure Depiction of
N~2~-[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]-N~2~-(2-fluorophenyl)-N-phenylglycinamide
N~2~-[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]-N~2~-(2-fluorophenyl)-N-phenylglycinamide
Compound characteristics
| Compound ID: | C998-1078 |
| Compound Name: | N~2~-[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]-N~2~-(2-fluorophenyl)-N-phenylglycinamide |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C19 H18 F N3 O3 S2 |
| Smiles: | C(C(Nc1ccccc1)=O)N(C1=N[C@@H]2CS(C[C@@H]2S1)(=O)=O)c1ccccc1F |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.6521 |
| logD: | 2.6521 |
| logSw: | -3.2395 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.863 |
| InChI Key: | DZFSWSUGHNDXLH-UHFFFAOYSA-N |