6,7-dimethoxy-1-phenyl-N-(prop-2-en-1-yl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Chemical Structure Depiction of
6,7-dimethoxy-1-phenyl-N-(prop-2-en-1-yl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide
6,7-dimethoxy-1-phenyl-N-(prop-2-en-1-yl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Compound characteristics
| Compound ID: | 8014-8350 |
| Compound Name: | 6,7-dimethoxy-1-phenyl-N-(prop-2-en-1-yl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide |
| Molecular Weight: | 368.5 |
| Molecular Formula: | C21 H24 N2 O2 S |
| Smiles: | COc1cc2CCN(C(c3ccccc3)c2cc1OC)C(NCC=C)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7299 |
| logD: | 3.7299 |
| logSw: | -3.9798 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.8073 |
| InChI Key: | XTNPDALGDVOCLE-FQEVSTJZSA-N |