3,3-dimethyl-1-{2-methyl-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}butan-1-one
Chemical Structure Depiction of
3,3-dimethyl-1-{2-methyl-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}butan-1-one
3,3-dimethyl-1-{2-methyl-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | V003-4136 |
| Compound Name: | 3,3-dimethyl-1-{2-methyl-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}butan-1-one |
| Molecular Weight: | 459.51 |
| Molecular Formula: | C25 H28 F3 N3 O2 |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(CC(C)(C)C)=O)C1c2ccccc2Oc2cc(ccc2N=1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4411 |
| logD: | 4.9256 |
| logSw: | -5.4842 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.681 |
| InChI Key: | SOBIQSXPBWVKKG-INIZCTEOSA-N |