3-(3,4-dimethoxyphenyl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
3-(3,4-dimethoxyphenyl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
Compound characteristics
| Compound ID: | Y032-2774 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]prop-2-enamide |
| Molecular Weight: | 333.41 |
| Molecular Formula: | C16 H19 N3 O3 S |
| Smiles: | CC(C)c1nnc(NC(/C=C/c2ccc(c(c2)OC)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.5614 |
| logD: | 3.5015 |
| logSw: | -3.8096 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.922 |
| InChI Key: | JWAVAXNSPWTVNC-UHFFFAOYSA-N |