N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | Y032-2638 |
| Compound Name: | N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide |
| Molecular Weight: | 374.46 |
| Molecular Formula: | C19 H22 N2 O4 S |
| Smiles: | COc1cc(/C=C/C(Nc2nc3CCCCc3s2)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.0794 |
| logD: | 3.9979 |
| logSw: | -4.1867 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.562 |
| InChI Key: | NJLIJESKXWTNNI-UHFFFAOYSA-N |