N-[rel-(3aR,5R,6aR)-2-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-N'-(3-methylbutyl)urea
Chemical Structure Depiction of
N-[rel-(3aR,5R,6aR)-2-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-N'-(3-methylbutyl)urea
N-[rel-(3aR,5R,6aR)-2-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-N'-(3-methylbutyl)urea
Compound characteristics
| Compound ID: | SB75-1530 |
| Compound Name: | N-[rel-(3aR,5R,6aR)-2-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-N'-(3-methylbutyl)urea |
| Molecular Weight: | 411.55 |
| Molecular Formula: | C23 H33 N5 O2 |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(Cc2ccccc2)C1)c1nc(C)no1)NC(NCCC(C)C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.3116 |
| logD: | 0.1654 |
| logSw: | -3.4313 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.374 |
| InChI Key: | DCFIUECAHAJUQK-VIZSFHNOSA-N |