propan-2-yl 2-{[2-(2-chlorophenyl)quinoline-4-carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-{[2-(2-chlorophenyl)quinoline-4-carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
propan-2-yl 2-{[2-(2-chlorophenyl)quinoline-4-carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y503-0645 |
| Compound Name: | propan-2-yl 2-{[2-(2-chlorophenyl)quinoline-4-carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 519.06 |
| Molecular Formula: | C29 H27 Cl N2 O3 S |
| Smiles: | CC1CCc2c(C(=O)OC(C)C)c(NC(c3cc(c4ccccc4[Cl])nc4ccccc34)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.8387 |
| logD: | 5.8994 |
| logSw: | -6.5867 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.536 |
| InChI Key: | FQPSACIYENSQJM-QGZVFWFLSA-N |