ethyl 2-{4-[butyl(methyl)sulfamoyl]benzamido}-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 2-{4-[butyl(methyl)sulfamoyl]benzamido}-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1)
ethyl 2-{4-[butyl(methyl)sulfamoyl]benzamido}-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | K408-0278 |
| Compound Name: | ethyl 2-{4-[butyl(methyl)sulfamoyl]benzamido}-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 544.13 |
| Molecular Formula: | C24 H33 N3 O5 S2 |
| Salt: | HCl |
| Smiles: | [H]N(C(c1ccc(cc1)S(N(C)CCCC)(=O)=O)=O)c1c(C(=O)OCC)c2CCN(CC)Cc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.0947 |
| logD: | -0.5709 |
| logSw: | -4.0544 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.083 |
| InChI Key: | COPJSTQKVMYNNV-UHFFFAOYSA-N |