N-(2,4-dimethoxyphenyl)-5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
N-(2,4-dimethoxyphenyl)-5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
Compound characteristics
| Compound ID: | Y043-1747 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide |
| Molecular Weight: | 379.48 |
| Molecular Formula: | C18 H25 N3 O4 S |
| Smiles: | COc1ccc(c(c1)OC)NC(CCCC[C@H]1[C@@H]2[C@H](CS1)NC(N2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.7979 |
| logD: | 1.7977 |
| logSw: | -2.4489 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.256 |
| InChI Key: | KVKNYTYTCWMOQG-LXZKKBNFSA-N |