3-(3-chlorophenyl)-2,8-dimethyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Chemical Structure Depiction of
3-(3-chlorophenyl)-2,8-dimethyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
3-(3-chlorophenyl)-2,8-dimethyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Compound characteristics
| Compound ID: | C269-0326 |
| Compound Name: | 3-(3-chlorophenyl)-2,8-dimethyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one |
| Molecular Weight: | 328.8 |
| Molecular Formula: | C18 H17 Cl N2 O2 |
| Smiles: | Cc1ccc2c(c1)C1CC(C)(N(C(N1)=O)c1cccc(c1)[Cl])O2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4208 |
| logD: | 4.4208 |
| logSw: | -4.643 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.077 |
| InChI Key: | IRESCICMCXORFK-UHFFFAOYSA-N |