N-(2-fluorophenyl)-N'-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]urea
Chemical Structure Depiction of
N-(2-fluorophenyl)-N'-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]urea
N-(2-fluorophenyl)-N'-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]urea
Compound characteristics
| Compound ID: | SB75-0991 |
| Compound Name: | N-(2-fluorophenyl)-N'-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]urea |
| Molecular Weight: | 423.46 |
| Molecular Formula: | C18 H22 F N5 O4 S |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)S(C)(=O)=O)c1nc(C)no1)NC(Nc1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4003 |
| logD: | 1.4003 |
| logSw: | -2.4149 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.983 |
| InChI Key: | XZGZWGQMHRDBJV-VBHSOAQHSA-N |