2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl piperidine-1-carbodithioate
Chemical Structure Depiction of
2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl piperidine-1-carbodithioate
2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl piperidine-1-carbodithioate
Compound characteristics
| Compound ID: | 5161-0089 |
| Compound Name: | 2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl piperidine-1-carbodithioate |
| Molecular Weight: | 396.57 |
| Molecular Formula: | C22 H24 N2 O S2 |
| Smiles: | C1CCN(CC1)C(=S)SCC(N1c2ccccc2CCc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4196 |
| logD: | 5.4196 |
| logSw: | -5.497 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 16.7651 |
| InChI Key: | IKWOHGMSHZSGAX-UHFFFAOYSA-N |