4-chloro-2-methoxy-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]benzamide
Chemical Structure Depiction of
4-chloro-2-methoxy-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]benzamide
4-chloro-2-methoxy-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]benzamide
Compound characteristics
| Compound ID: | SB75-1128 |
| Compound Name: | 4-chloro-2-methoxy-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]benzamide |
| Molecular Weight: | 446.93 |
| Molecular Formula: | C22 H27 Cl N4 O4 |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)C(C(C)C)=O)c1nc(C)no1)NC(c1ccc(cc1OC)[Cl])=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.658 |
| logD: | 3.6579 |
| logSw: | -4.0948 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.545 |
| InChI Key: | ABTTWDUJXNTCSK-YGHRGLEHSA-N |