5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-[3-(1H-tetrazol-1-yl)phenyl]pentanamide
Chemical Structure Depiction of
5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-[3-(1H-tetrazol-1-yl)phenyl]pentanamide
5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-[3-(1H-tetrazol-1-yl)phenyl]pentanamide
Compound characteristics
Compound ID: | Y043-3500 |
Compound Name: | 5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-[3-(1H-tetrazol-1-yl)phenyl]pentanamide |
Molecular Weight: | 387.46 |
Molecular Formula: | C17 H21 N7 O2 S |
Smiles: | C(CC[C@H]1[C@@H]2[C@H](CS1)NC(N2)=O)CC(Nc1cccc(c1)n1cnnn1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 1.4142 |
logD: | 1.4142 |
logSw: | -2.4863 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 100.545 |
InChI Key: | IFUJLMJEPKIIFC-LZWOXQAQSA-N |