3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-N-(4-ethoxyphenyl)-N-methyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide
Chemical Structure Depiction of
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-N-(4-ethoxyphenyl)-N-methyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-N-(4-ethoxyphenyl)-N-methyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide
Compound characteristics
| Compound ID: | K917-0434 |
| Compound Name: | 3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-N-(4-ethoxyphenyl)-N-methyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide |
| Molecular Weight: | 517.6 |
| Molecular Formula: | C28 H27 N3 O5 S |
| Smiles: | CCOc1ccc(cc1)N(C)S(c1ccc2c(c1)C(C(=CN2)C(N1CCc2ccccc2C1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.38 |
| logD: | 3.0568 |
| logSw: | -4.1309 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.613 |
| InChI Key: | UARVKTJFYCDUST-UHFFFAOYSA-N |