1-methyl-5-[rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]hexahydrocyclopenta[c]pyrrole-2(1H)-sulfonyl]-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
1-methyl-5-[rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]hexahydrocyclopenta[c]pyrrole-2(1H)-sulfonyl]-1,3-dihydro-2H-indol-2-one
1-methyl-5-[rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]hexahydrocyclopenta[c]pyrrole-2(1H)-sulfonyl]-1,3-dihydro-2H-indol-2-one
Compound characteristics
| Compound ID: | SB55-1083 |
| Compound Name: | 1-methyl-5-[rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]hexahydrocyclopenta[c]pyrrole-2(1H)-sulfonyl]-1,3-dihydro-2H-indol-2-one |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C21 H26 N4 O4 S |
| Smiles: | [H][C@@]12CCC[C@]2(CN(C1)S(c1ccc2c(CC(N2C)=O)c1)(=O)=O)c1nc(C(C)C)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.2237 |
| logD: | 3.2237 |
| logSw: | -3.579 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.93 |
| InChI Key: | RKFOKKRITIHKGF-VFNWGFHPSA-N |