10-chloro-3-(2,6-dimethylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Chemical Structure Depiction of
10-chloro-3-(2,6-dimethylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
10-chloro-3-(2,6-dimethylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Compound characteristics
| Compound ID: | K272-2827 |
| Compound Name: | 10-chloro-3-(2,6-dimethylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione |
| Molecular Weight: | 358.89 |
| Molecular Formula: | C19 H19 Cl N2 O S |
| Smiles: | Cc1cccc(C)c1N1C(NC2CC1(C)Oc1c2cccc1[Cl])=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9991 |
| logD: | 4.9991 |
| logSw: | -5.1252 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 18.9968 |
| InChI Key: | BEHMPDPUVFKUJY-UHFFFAOYSA-N |