N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
Chemical Structure Depiction of
N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
Compound characteristics
Compound ID: | SB75-0186 |
Compound Name: | N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide |
Molecular Weight: | 460.55 |
Molecular Formula: | C22 H28 N4 O5 S |
Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)S(C)(=O)=O)c1nc(C)no1)NC(C1(CC1)c1ccc(cc1)OC)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 1.7902 |
logD: | 1.7902 |
logSw: | -2.6575 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 95.265 |
InChI Key: | JJRFQJKKBAAVQI-JLHGSKIFSA-N |