ethyl 4-{4-[(3-carbamoyl-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)carbamoyl]benzene-1-sulfonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-[(3-carbamoyl-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)carbamoyl]benzene-1-sulfonyl}piperazine-1-carboxylate
ethyl 4-{4-[(3-carbamoyl-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)carbamoyl]benzene-1-sulfonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | K408-0319 |
| Compound Name: | ethyl 4-{4-[(3-carbamoyl-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)carbamoyl]benzene-1-sulfonyl}piperazine-1-carboxylate |
| Molecular Weight: | 549.67 |
| Molecular Formula: | C24 H31 N5 O6 S2 |
| Smiles: | [H]N(C(c1ccc(cc1)S(N1CCN(CC1)C(=O)OCC)(=O)=O)=O)c1c(C(N)=O)c2CCN(CC)Cc2s1 |
| Stereo: | ACHIRAL |
| logP: | 0.948 |
| logD: | -1.648 |
| logSw: | -2.5457 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.065 |
| InChI Key: | VOYCHQCXKCMEFU-UHFFFAOYSA-N |