N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-3-(thiophen-2-yl)prop-2-enamide
Chemical Structure Depiction of
N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-3-(thiophen-2-yl)prop-2-enamide
N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-3-(thiophen-2-yl)prop-2-enamide
Compound characteristics
Compound ID: | G786-2375 |
Compound Name: | N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-3-(thiophen-2-yl)prop-2-enamide |
Molecular Weight: | 465.61 |
Molecular Formula: | C23 H19 N3 O2 S3 |
Smiles: | CC(N1CCc2c(c(NC(/C=C/c3cccs3)=O)sc2C1)c1nc2ccccc2s1)=O |
Stereo: | ACHIRAL |
logP: | 4.7308 |
logD: | 4.7245 |
logSw: | -4.5575 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.428 |
InChI Key: | FXGYTJWGLCQDSB-UHFFFAOYSA-N |