2-[(3-ethoxyphenyl)methyl]-1-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Chemical Structure Depiction of
2-[(3-ethoxyphenyl)methyl]-1-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
2-[(3-ethoxyphenyl)methyl]-1-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Compound characteristics
| Compound ID: | V023-2263 |
| Compound Name: | 2-[(3-ethoxyphenyl)methyl]-1-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine |
| Molecular Weight: | 414.47 |
| Molecular Formula: | C24 H25 F3 N2 O |
| Smiles: | CCOc1cccc(CN2CCCn3cccc3C2c2cccc(c2)C(F)(F)F)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.855 |
| logD: | 5.7732 |
| logSw: | -5.6843 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 13.0654 |
| InChI Key: | JQDDYFTWWPHIOZ-HSZRJFAPSA-N |