1-[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]-1,4-diazabicyclo[2.2.2]octan-1-ium--chloride (1/1)
Chemical Structure Depiction of
1-[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]-1,4-diazabicyclo[2.2.2]octan-1-ium--chloride (1/1)
1-[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]-1,4-diazabicyclo[2.2.2]octan-1-ium--chloride (1/1)
Compound characteristics
| Compound ID: | 3228-0105 |
| Compound Name: | 1-[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]-1,4-diazabicyclo[2.2.2]octan-1-ium--chloride (1/1) |
| Molecular Weight: | 387.93 |
| Molecular Formula: | C20 H22 N3 O S |
| Salt: | Cl- |
| Smiles: | C1C[N+]2(CCN1CC2)CC(N1c2ccccc2Sc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3617 |
| logD: | 2.3617 |
| logSw: | -2.5134 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 17.3154 |
| InChI Key: | MTXIYGZJBPUHTN-UHFFFAOYSA-N |