ethyl 3-(1,3-benzothiazol-2-yl)-2-pentanamido-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
Chemical Structure Depiction of
ethyl 3-(1,3-benzothiazol-2-yl)-2-pentanamido-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
ethyl 3-(1,3-benzothiazol-2-yl)-2-pentanamido-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
Compound characteristics
| Compound ID: | G786-2362 |
| Compound Name: | ethyl 3-(1,3-benzothiazol-2-yl)-2-pentanamido-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C22 H25 N3 O3 S2 |
| Smiles: | CCCCC(Nc1c(c2CCN(Cc2s1)C(=O)OCC)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0731 |
| logD: | 5.0673 |
| logSw: | -4.7248 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.265 |
| InChI Key: | MMHFVNQYDZKPFT-UHFFFAOYSA-N |