N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-4-(morpholine-4-sulfonyl)benzamide
Chemical Structure Depiction of
N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-4-(morpholine-4-sulfonyl)benzamide
N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-4-(morpholine-4-sulfonyl)benzamide
Compound characteristics
| Compound ID: | K408-0891 |
| Compound Name: | N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-4-(morpholine-4-sulfonyl)benzamide |
| Molecular Weight: | 582.72 |
| Molecular Formula: | C27 H26 N4 O5 S3 |
| Smiles: | [H]N(C(c1ccc(cc1)S(N1CCOCC1)(=O)=O)=O)c1c(c2CCN(Cc2s1)C(C)=O)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.5904 |
| logD: | 3.315 |
| logSw: | -3.9819 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.242 |
| InChI Key: | KIPCRSOXHVXRNK-UHFFFAOYSA-N |