6,7-dimethoxy-N-phenyl-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Chemical Structure Depiction of
6,7-dimethoxy-N-phenyl-3,4-dihydroisoquinoline-2(1H)-carbothioamide
6,7-dimethoxy-N-phenyl-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Compound characteristics
| Compound ID: | 5503-0076 |
| Compound Name: | 6,7-dimethoxy-N-phenyl-3,4-dihydroisoquinoline-2(1H)-carbothioamide |
| Molecular Weight: | 328.43 |
| Molecular Formula: | C18 H20 N2 O2 S |
| Smiles: | COc1cc2CCN(Cc2cc1OC)C(Nc1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.4223 |
| logD: | 3.4223 |
| logSw: | -3.7668 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.0594 |
| InChI Key: | RRYQOPSEGQPMDL-UHFFFAOYSA-N |