3-(4-ethoxyphenyl)-8-methoxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-8-methoxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
3-(4-ethoxyphenyl)-8-methoxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Compound characteristics
| Compound ID: | K272-2907 |
| Compound Name: | 3-(4-ethoxyphenyl)-8-methoxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione |
| Molecular Weight: | 370.47 |
| Molecular Formula: | C20 H22 N2 O3 S |
| Smiles: | CCOc1ccc(cc1)N1C(NC2CC1(C)Oc1ccc(cc12)OC)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0044 |
| logD: | 4.0044 |
| logSw: | -4.2041 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.582 |
| InChI Key: | VHTVZGVTYHOSDH-UHFFFAOYSA-N |