5-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-3-phenyl-1,2,4-oxadiazole
Chemical Structure Depiction of
5-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-3-phenyl-1,2,4-oxadiazole
5-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-3-phenyl-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | L106-0017 |
| Compound Name: | 5-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-3-phenyl-1,2,4-oxadiazole |
| Molecular Weight: | 356.44 |
| Molecular Formula: | C19 H20 N2 O3 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(Cc1nc(c2ccccc2)no1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.876 |
| logD: | 4.876 |
| logSw: | -4.6256 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.346 |
| InChI Key: | ROGKGPVLGIIVBR-UHFFFAOYSA-N |