rel-(3aR,6aR)-2-[(4-chlorophenyl)methyl]-5-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydropyrrolo[3,4-c]pyrrole
Chemical Structure Depiction of
rel-(3aR,6aR)-2-[(4-chlorophenyl)methyl]-5-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydropyrrolo[3,4-c]pyrrole
rel-(3aR,6aR)-2-[(4-chlorophenyl)methyl]-5-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydropyrrolo[3,4-c]pyrrole
Compound characteristics
| Compound ID: | S988-0410 |
| Compound Name: | rel-(3aR,6aR)-2-[(4-chlorophenyl)methyl]-5-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydropyrrolo[3,4-c]pyrrole |
| Molecular Weight: | 410.92 |
| Molecular Formula: | C18 H23 Cl N4 O3 S |
| Smiles: | CCS(N1C[C@@H]2CN(Cc3ccc(cc3)[Cl])C[C@@]2(C1)c1nc(C)no1)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.2054 |
| logD: | -0.194 |
| logSw: | -2.9887 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.332 |
| InChI Key: | LFCXDEUAGCHEQX-QAPCUYQASA-N |