3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]propanamide
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]propanamide
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]propanamide
Compound characteristics
| Compound ID: | SB75-1027 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]propanamide |
| Molecular Weight: | 436.53 |
| Molecular Formula: | C19 H28 N6 O4 S |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)S(C)(=O)=O)c1nc(C)no1)NC(CCn1c(C)cc(C)n1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.0691 |
| logD: | -0.0691 |
| logSw: | -1.9866 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.241 |
| InChI Key: | AERDXFSUHXDDHQ-GJYPPUQNSA-N |