3-(thiophen-2-yl)-11-[4-(trifluoromethoxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
3-(thiophen-2-yl)-11-[4-(trifluoromethoxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
3-(thiophen-2-yl)-11-[4-(trifluoromethoxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 5071-7865 |
| Compound Name: | 3-(thiophen-2-yl)-11-[4-(trifluoromethoxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 456.49 |
| Molecular Formula: | C24 H19 F3 N2 O2 S |
| Smiles: | C1C(CC(C2C(c3ccc(cc3)OC(F)(F)F)Nc3ccccc3NC1=2)=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0096 |
| logD: | 5.9976 |
| logSw: | -5.8959 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.432 |
| InChI Key: | GIRPQDHFVCPOHR-UHFFFAOYSA-N |