rel-(3aR,6aR)-2-{[(2-chlorophenyl)methyl](phenyl)amino}-3a,4,6,6a-tetrahydro-5H-5lambda~6~-thieno[3,4-d][1,3]thiazole-5,5-dione
Chemical Structure Depiction of
rel-(3aR,6aR)-2-{[(2-chlorophenyl)methyl](phenyl)amino}-3a,4,6,6a-tetrahydro-5H-5lambda~6~-thieno[3,4-d][1,3]thiazole-5,5-dione
rel-(3aR,6aR)-2-{[(2-chlorophenyl)methyl](phenyl)amino}-3a,4,6,6a-tetrahydro-5H-5lambda~6~-thieno[3,4-d][1,3]thiazole-5,5-dione
Compound characteristics
| Compound ID: | C998-0574 |
| Compound Name: | rel-(3aR,6aR)-2-{[(2-chlorophenyl)methyl](phenyl)amino}-3a,4,6,6a-tetrahydro-5H-5lambda~6~-thieno[3,4-d][1,3]thiazole-5,5-dione |
| Molecular Weight: | 392.92 |
| Molecular Formula: | C18 H17 Cl N2 O2 S2 |
| Smiles: | C(c1ccccc1[Cl])N(C1=N[C@@H]2CS(C[C@@H]2S1)(=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.8237 |
| logD: | 3.8237 |
| logSw: | -4.1727 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.015 |
| InChI Key: | BXBIUWDDFALTTH-UHFFFAOYSA-N |