ethyl 2-[(5-nitrofuran-2-carbonyl)amino]-6-(propan-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 2-[(5-nitrofuran-2-carbonyl)amino]-6-(propan-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1)
ethyl 2-[(5-nitrofuran-2-carbonyl)amino]-6-(propan-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | G856-5923 |
| Compound Name: | ethyl 2-[(5-nitrofuran-2-carbonyl)amino]-6-(propan-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 443.9 |
| Molecular Formula: | C18 H21 N3 O6 S |
| Salt: | HCl |
| Smiles: | CCOC(c1c2CCN(Cc2sc1NC(c1ccc([N+]([O-])=O)o1)=O)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.035 |
| logD: | -1.985 |
| logSw: | -3.4721 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.256 |
| InChI Key: | WQBBZZYWRYZIOG-UHFFFAOYSA-N |