5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]pentanamide
Chemical Structure Depiction of
5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]pentanamide
5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]pentanamide
Compound characteristics
| Compound ID: | Y043-1775 |
| Compound Name: | 5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]pentanamide |
| Molecular Weight: | 431.58 |
| Molecular Formula: | C20 H25 N5 O2 S2 |
| Smiles: | C(CC[C@H]1[C@@H]2[C@H](CS1)NC(N2)=O)CC(Nc1nnc(CCc2ccccc2)s1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1958 |
| logD: | 3.1137 |
| logSw: | -3.4318 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.548 |
| InChI Key: | BGHGFEDFFONNAD-HDMKZQKVSA-N |