1-(2,3-dimethoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Chemical Structure Depiction of
1-(2,3-dimethoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
1-(2,3-dimethoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Compound characteristics
| Compound ID: | V005-7612 |
| Compound Name: | 1-(2,3-dimethoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine |
| Molecular Weight: | 430.47 |
| Molecular Formula: | C24 H25 F3 N2 O2 |
| Salt: | not_available |
| Smiles: | COc1cccc(C2c3cccn3CCCN2Cc2cccc(c2)C(F)(F)F)c1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1353 |
| logD: | 5.0492 |
| logSw: | -5.2163 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.2893 |
| InChI Key: | KDQDMPZZFPWIGJ-JOCHJYFZSA-N |