3-[1-(2-methylbenzene-1-sulfonyl)pyrrolidin-3-yl]-5-[(4-methylphenoxy)methyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
3-[1-(2-methylbenzene-1-sulfonyl)pyrrolidin-3-yl]-5-[(4-methylphenoxy)methyl]-1,2,4-oxadiazole
3-[1-(2-methylbenzene-1-sulfonyl)pyrrolidin-3-yl]-5-[(4-methylphenoxy)methyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | S592-0410 |
| Compound Name: | 3-[1-(2-methylbenzene-1-sulfonyl)pyrrolidin-3-yl]-5-[(4-methylphenoxy)methyl]-1,2,4-oxadiazole |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C21 H23 N3 O4 S |
| Smiles: | Cc1ccc(cc1)OCc1nc(C2CCN(C2)S(c2ccccc2C)(=O)=O)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0556 |
| logD: | 4.0556 |
| logSw: | -3.978 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.819 |
| InChI Key: | LHNVBKMALZFEFP-QGZVFWFLSA-N |