2-[rel-(3R,4R)-1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-(propan-2-yl)-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[rel-(3R,4R)-1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-(propan-2-yl)-1,3,4-oxadiazole
2-[rel-(3R,4R)-1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-(propan-2-yl)-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | SB54-0339 |
| Compound Name: | 2-[rel-(3R,4R)-1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-(propan-2-yl)-1,3,4-oxadiazole |
| Molecular Weight: | 384.45 |
| Molecular Formula: | C16 H24 N4 O5 S |
| Smiles: | CC(C)c1nnc([C@@H]2CN(C[C@H]2COC)S(c2c(C)noc2C)(=O)=O)o1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.214 |
| logD: | 1.214 |
| logSw: | -2.1793 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 93.16 |
| InChI Key: | XWTXGIRSBZPSPK-QWHCGFSZSA-N |