methyl 3-{[7-(furan-2-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl]amino}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[7-(furan-2-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl]amino}thiophene-2-carboxylate
methyl 3-{[7-(furan-2-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl]amino}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G491-0643 |
| Compound Name: | methyl 3-{[7-(furan-2-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl]amino}thiophene-2-carboxylate |
| Molecular Weight: | 412.42 |
| Molecular Formula: | C20 H16 N2 O6 S |
| Smiles: | COC(c1c(ccs1)NC(C1=CC2=C(CC(CC2=O)c2ccco2)NC1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1849 |
| logD: | -1.4646 |
| logSw: | -2.7734 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.227 |
| InChI Key: | PQKQILLHNJQSKX-JTQLQIEISA-N |