N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]-3-(4-methyl-1H-pyrazol-1-yl)propanamide
Chemical Structure Depiction of
N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]-3-(4-methyl-1H-pyrazol-1-yl)propanamide
N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]-3-(4-methyl-1H-pyrazol-1-yl)propanamide
Compound characteristics
| Compound ID: | SB75-0151 |
| Compound Name: | N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]-3-(4-methyl-1H-pyrazol-1-yl)propanamide |
| Molecular Weight: | 414.51 |
| Molecular Formula: | C21 H30 N6 O3 |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)C(C(C)C)=O)c1nc(C)no1)NC(CCn1cc(C)cn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2699 |
| logD: | 1.2699 |
| logSw: | -1.6766 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.456 |
| InChI Key: | UBCQOYKPHKUAHU-WWMYMODYSA-N |