N-{2-[(4-chlorophenyl)sulfanyl]-5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl}acetamide
Chemical Structure Depiction of
N-{2-[(4-chlorophenyl)sulfanyl]-5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl}acetamide
N-{2-[(4-chlorophenyl)sulfanyl]-5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl}acetamide
Compound characteristics
| Compound ID: | K786-2918 |
| Compound Name: | N-{2-[(4-chlorophenyl)sulfanyl]-5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl}acetamide |
| Molecular Weight: | 436.96 |
| Molecular Formula: | C24 H21 Cl N2 O2 S |
| Smiles: | CC(Nc1cc(ccc1Sc1ccc(cc1)[Cl])C(N1CCc2ccccc2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.796 |
| logD: | 4.796 |
| logSw: | -4.7923 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.841 |
| InChI Key: | AZCZUJXXZVCYCZ-UHFFFAOYSA-N |