2,2,2-trifluoro-1-[1-hydroxy-11-(3-methoxyphenyl)-3-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethan-1-one
Chemical Structure Depiction of
2,2,2-trifluoro-1-[1-hydroxy-11-(3-methoxyphenyl)-3-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethan-1-one
2,2,2-trifluoro-1-[1-hydroxy-11-(3-methoxyphenyl)-3-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethan-1-one
Compound characteristics
| Compound ID: | F019-0959 |
| Compound Name: | 2,2,2-trifluoro-1-[1-hydroxy-11-(3-methoxyphenyl)-3-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethan-1-one |
| Molecular Weight: | 492.5 |
| Molecular Formula: | C28 H23 F3 N2 O3 |
| Smiles: | COc1cccc(c1)C1C2=C(CC(CC2=Nc2ccccc2N1C(C(F)(F)F)=O)c1ccccc1)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3336 |
| logD: | 5.3323 |
| logSw: | -5.2206 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.829 |
| InChI Key: | QUTKBWLGWRDVTL-UHFFFAOYSA-N |