methyl 2-[4-(methoxycarbonyl)benzamido]-6-(propan-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
methyl 2-[4-(methoxycarbonyl)benzamido]-6-(propan-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1)
methyl 2-[4-(methoxycarbonyl)benzamido]-6-(propan-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | G856-5956 |
| Compound Name: | methyl 2-[4-(methoxycarbonyl)benzamido]-6-(propan-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 452.96 |
| Molecular Formula: | C21 H24 N2 O5 S |
| Salt: | HCl |
| Smiles: | CC(C)N1CCc2c(C(=O)OC)c(NC(c3ccc(cc3)C(=O)OC)=O)sc2C1 |
| Stereo: | ACHIRAL |
| logP: | 3.5289 |
| logD: | -0.7642 |
| logSw: | -4.0264 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.19 |
| InChI Key: | CYEHUMQSFOSSHA-UHFFFAOYSA-N |