2-methoxy-1-{4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-methoxy-1-{4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}ethan-1-one
2-methoxy-1-{4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V004-3772 |
| Compound Name: | 2-methoxy-1-{4-[2-methyl-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 433.43 |
| Molecular Formula: | C22 H22 F3 N3 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc2c(c1)C(=Nc1cc(ccc1O2)C(F)(F)F)N1CCN(CC1)C(COC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0709 |
| logD: | 2.3723 |
| logSw: | -3.3537 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.886 |
| InChI Key: | XHCDIQVNDAJJBE-UHFFFAOYSA-N |