1-(3,4-dimethylphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Chemical Structure Depiction of
1-(3,4-dimethylphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
1-(3,4-dimethylphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Compound characteristics
| Compound ID: | V023-2251 |
| Compound Name: | 1-(3,4-dimethylphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine |
| Molecular Weight: | 398.47 |
| Molecular Formula: | C24 H25 F3 N2 |
| Smiles: | Cc1ccc(cc1C)C1c2cccn2CCCN1Cc1cccc(c1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3352 |
| logD: | 6.3129 |
| logSw: | -5.863 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 5.9418 |
| InChI Key: | ACSVAICOMRWMJR-HSZRJFAPSA-N |