N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]-1H-1,2,4-triazole-3-carboxamide
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]-1H-1,2,4-triazole-3-carboxamide
N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | SB75-1047 |
| Compound Name: | N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 373.41 |
| Molecular Formula: | C17 H23 N7 O3 |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)C(C(C)C)=O)c1nc(C)no1)NC(c1nc[nH]n1)=O |
| Stereo: | RELATIVE |
| logP: | 0.1637 |
| logD: | 0.0392 |
| logSw: | -1.4849 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.618 |
| InChI Key: | RWNKRESFJCUSCJ-QFSBIZTOSA-N |