6-hydroxy-7-methoxy-1-methyl-N-(prop-2-en-1-yl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Chemical Structure Depiction of
6-hydroxy-7-methoxy-1-methyl-N-(prop-2-en-1-yl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide
6-hydroxy-7-methoxy-1-methyl-N-(prop-2-en-1-yl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Compound characteristics
| Compound ID: | 8020-3123 |
| Compound Name: | 6-hydroxy-7-methoxy-1-methyl-N-(prop-2-en-1-yl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide |
| Molecular Weight: | 292.4 |
| Molecular Formula: | C15 H20 N2 O2 S |
| Smiles: | CC1c2cc(c(cc2CCN1C(NCC=C)=S)O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0779 |
| logD: | 2.0736 |
| logSw: | -2.2099 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.588 |
| InChI Key: | PGCUPACPWJXMOO-JTQLQIEISA-N |