methyl 2-{[2-(2,4-dimethoxyphenyl)quinoline-4-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(2,4-dimethoxyphenyl)quinoline-4-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
methyl 2-{[2-(2,4-dimethoxyphenyl)quinoline-4-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y503-0093 |
| Compound Name: | methyl 2-{[2-(2,4-dimethoxyphenyl)quinoline-4-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 488.56 |
| Molecular Formula: | C27 H24 N2 O5 S |
| Smiles: | COC(c1c2CCCc2sc1NC(c1cc(c2ccc(cc2OC)OC)nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6164 |
| logD: | 3.6567 |
| logSw: | -5.7206 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.818 |
| InChI Key: | GHWQFLYXKUVILA-UHFFFAOYSA-N |