N-[rel-(2Z,3aR,6aR)-5,5-dioxo-3-phenylhexahydro-2H-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-ylidene]-2-methoxybenzamide
Chemical Structure Depiction of
N-[rel-(2Z,3aR,6aR)-5,5-dioxo-3-phenylhexahydro-2H-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-ylidene]-2-methoxybenzamide
N-[rel-(2Z,3aR,6aR)-5,5-dioxo-3-phenylhexahydro-2H-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-ylidene]-2-methoxybenzamide
Compound characteristics
| Compound ID: | 6376-0028 |
| Compound Name: | N-[rel-(2Z,3aR,6aR)-5,5-dioxo-3-phenylhexahydro-2H-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-ylidene]-2-methoxybenzamide |
| Molecular Weight: | 402.49 |
| Molecular Formula: | C19 H18 N2 O4 S2 |
| Smiles: | COc1ccccc1C(/N=C1/N(c2ccccc2)[C@@H]2CS(C[C@@H]2S1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9364 |
| logD: | 1.9364 |
| logSw: | -2.7505 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.26 |
| InChI Key: | NVTHOMIZTHPVSE-UHFFFAOYSA-N |