ethyl 2-{2-[(1,3-benzothiazol-2-yl)sulfanyl]acetamido}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(1,3-benzothiazol-2-yl)sulfanyl]acetamido}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
ethyl 2-{2-[(1,3-benzothiazol-2-yl)sulfanyl]acetamido}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Compound characteristics
| Compound ID: | 3448-4169 |
| Compound Name: | ethyl 2-{2-[(1,3-benzothiazol-2-yl)sulfanyl]acetamido}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate |
| Molecular Weight: | 447.6 |
| Molecular Formula: | C20 H21 N3 O3 S3 |
| Smiles: | CCOC(c1c2CCN(C)Cc2sc1NC(CSc1nc2ccccc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9409 |
| logD: | 1.394 |
| logSw: | -4.1313 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.076 |
| InChI Key: | GQNUBDSQPKPTIV-UHFFFAOYSA-N |