10-methoxy-2,11-dimethyl-3-(3-methylphenyl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Chemical Structure Depiction of
10-methoxy-2,11-dimethyl-3-(3-methylphenyl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
10-methoxy-2,11-dimethyl-3-(3-methylphenyl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Compound characteristics
| Compound ID: | C339-0023 |
| Compound Name: | 10-methoxy-2,11-dimethyl-3-(3-methylphenyl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C20 H22 N2 O2 S |
| Smiles: | CC1C2c3cccc(c3OC1(C)N(C(N2)=S)c1cccc(C)c1)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4406 |
| logD: | 4.4406 |
| logSw: | -4.3972 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.8269 |
| InChI Key: | NRBZBIACSUVEKB-UHFFFAOYSA-N |