N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
Chemical Structure Depiction of
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
Compound characteristics
| Compound ID: | Y043-1404 |
| Compound Name: | N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide |
| Molecular Weight: | 355.48 |
| Molecular Formula: | C14 H21 N5 O2 S2 |
| Smiles: | CCc1nnc(NC(CCCC[C@H]2[C@@H]3[C@H](CS2)NC(N3)=O)=O)s1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.644 |
| logD: | 1.5583 |
| logSw: | -2.3282 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.819 |
| InChI Key: | YIZCIHFJGXBDGX-YGOYTEALSA-N |