3-acetamido-4-[(4-chlorophenyl)sulfanyl]-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]benzamide
Chemical Structure Depiction of
3-acetamido-4-[(4-chlorophenyl)sulfanyl]-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]benzamide
3-acetamido-4-[(4-chlorophenyl)sulfanyl]-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | K786-2155 |
| Compound Name: | 3-acetamido-4-[(4-chlorophenyl)sulfanyl]-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]benzamide |
| Molecular Weight: | 480.03 |
| Molecular Formula: | C26 H26 Cl N3 O2 S |
| Smiles: | CC(Nc1cc(ccc1Sc1ccc(cc1)[Cl])C(NCCN1CCc2ccccc2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7244 |
| logD: | 4.6105 |
| logSw: | -4.7552 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.43 |
| InChI Key: | WEVMDFIBAIOAOY-UHFFFAOYSA-N |