3-(2H-1,3-benzodioxol-5-yl)-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
3-(2H-1,3-benzodioxol-5-yl)-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
Compound characteristics
| Compound ID: | 5628-0897 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide |
| Molecular Weight: | 319.34 |
| Molecular Formula: | C14 H13 N3 O4 S |
| Smiles: | COCc1nnc(NC(/C=C/c2ccc3c(c2)OCO3)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.6484 |
| logD: | 2.583 |
| logSw: | -3.1773 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.696 |
| InChI Key: | MPAWDOYSECXKLT-UHFFFAOYSA-N |