N-(6-bromo-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-3-(thiophen-2-yl)prop-2-enamide
Chemical Structure Depiction of
N-(6-bromo-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-3-(thiophen-2-yl)prop-2-enamide
N-(6-bromo-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-3-(thiophen-2-yl)prop-2-enamide
Compound characteristics
| Compound ID: | G856-6949 |
| Compound Name: | N-(6-bromo-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-3-(thiophen-2-yl)prop-2-enamide |
| Molecular Weight: | 456.38 |
| Molecular Formula: | C20 H14 Br N3 O S2 |
| Smiles: | C(c1cccnc1)N(C(/C=C/c1cccs1)=O)c1nc2ccc(cc2s1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.9705 |
| logD: | 4.9702 |
| logSw: | -4.7117 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.134 |
| InChI Key: | JZONEQBWOYACHT-UHFFFAOYSA-N |