5-(2H-1,3-benzodioxol-5-yl)-N-[2-(benzylsulfanyl)ethyl]-3-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-N-[2-(benzylsulfanyl)ethyl]-3-methyl-1,2-oxazole-4-carboxamide
5-(2H-1,3-benzodioxol-5-yl)-N-[2-(benzylsulfanyl)ethyl]-3-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V005-2440 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-N-[2-(benzylsulfanyl)ethyl]-3-methyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 396.46 |
| Molecular Formula: | C21 H20 N2 O4 S |
| Smiles: | Cc1c(C(NCCSCc2ccccc2)=O)c(c2ccc3c(c2)OCO3)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.7462 |
| logD: | 3.7462 |
| logSw: | -4.2602 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.954 |
| InChI Key: | SZDCWLIMSNISGC-UHFFFAOYSA-N |