3-ethyl-10-methoxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Chemical Structure Depiction of
3-ethyl-10-methoxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
3-ethyl-10-methoxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Compound characteristics
| Compound ID: | K272-2286 |
| Compound Name: | 3-ethyl-10-methoxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione |
| Molecular Weight: | 278.37 |
| Molecular Formula: | C14 H18 N2 O2 S |
| Smiles: | CCN1C(NC2CC1(C)Oc1c2cccc1OC)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6915 |
| logD: | 2.6915 |
| logSw: | -2.9355 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.8369 |
| InChI Key: | PURHAUULBNHHIN-UHFFFAOYSA-N |