2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}-N-(2-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}-N-(2-ethoxyphenyl)acetamide
2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}-N-(2-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | L112-0680 |
| Compound Name: | 2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}-N-(2-ethoxyphenyl)acetamide |
| Molecular Weight: | 470.59 |
| Molecular Formula: | C27 H26 N4 O2 S |
| Smiles: | CCOc1ccccc1NC(CSc1c2ccccc2nc(n1)N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0672 |
| logD: | 6.0629 |
| logSw: | -5.7264 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.088 |
| InChI Key: | YLHKWKSWJHVHAY-UHFFFAOYSA-N |