ethyl 2-[4-(azepane-1-sulfonyl)benzamido]-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[4-(azepane-1-sulfonyl)benzamido]-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
ethyl 2-[4-(azepane-1-sulfonyl)benzamido]-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Compound characteristics
| Compound ID: | K408-0051 |
| Compound Name: | ethyl 2-[4-(azepane-1-sulfonyl)benzamido]-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate |
| Molecular Weight: | 505.65 |
| Molecular Formula: | C24 H31 N3 O5 S2 |
| Smiles: | [H]N(C(c1ccc(cc1)S(N1CCCCCC1)(=O)=O)=O)c1c(C(=O)OCC)c2CCN(C)Cc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.3826 |
| logD: | -1.2831 |
| logSw: | -3.9355 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.25 |
| InChI Key: | AWZRUBWCRAXMEG-UHFFFAOYSA-N |