methyl 2-{[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]amino}-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]amino}-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-{[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]amino}-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2260-1012 |
| Compound Name: | methyl 2-{[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]amino}-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 572.72 |
| Molecular Formula: | C33 H36 N2 O5 S |
| Smiles: | CCC(C)(C)C1CCc2c(C(=O)OC)c(NC(c3cc(c4ccc(c(c4)OC)OC)nc4ccccc34)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.2581 |
| logD: | 5.3188 |
| logSw: | -5.9045 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.538 |
| InChI Key: | BZODFKLWKOAKSQ-HXUWFJFHSA-N |