N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-4-bromobenzamide
Chemical Structure Depiction of
N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-4-bromobenzamide
N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-4-bromobenzamide
Compound characteristics
| Compound ID: | G856-5980 |
| Compound Name: | N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-4-bromobenzamide |
| Molecular Weight: | 484.44 |
| Molecular Formula: | C22 H18 Br N3 O S2 |
| Smiles: | CN1CCc2c(c(NC(c3ccc(cc3)[Br])=O)sc2C1)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 5.4814 |
| logD: | 4.7689 |
| logSw: | -5.5579 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.903 |
| InChI Key: | BMCQMMJXVBFIKB-UHFFFAOYSA-N |