10-methoxy-2-methyl-3-(prop-2-en-1-yl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Chemical Structure Depiction of
10-methoxy-2-methyl-3-(prop-2-en-1-yl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
10-methoxy-2-methyl-3-(prop-2-en-1-yl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Compound characteristics
| Compound ID: | C200-1264 |
| Compound Name: | 10-methoxy-2-methyl-3-(prop-2-en-1-yl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione |
| Molecular Weight: | 290.38 |
| Molecular Formula: | C15 H18 N2 O2 S |
| Smiles: | CC12CC(c3cccc(c3O2)OC)NC(N1CC=C)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8775 |
| logD: | 2.8775 |
| logSw: | -3.3716 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.0905 |
| InChI Key: | WAVQDXUGWRUHRQ-UHFFFAOYSA-N |