2-[(3-phenoxyphenyl)methyl]-1-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Chemical Structure Depiction of
2-[(3-phenoxyphenyl)methyl]-1-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
2-[(3-phenoxyphenyl)methyl]-1-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Compound characteristics
| Compound ID: | V031-2766 |
| Compound Name: | 2-[(3-phenoxyphenyl)methyl]-1-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine |
| Molecular Weight: | 462.51 |
| Molecular Formula: | C28 H25 F3 N2 O |
| Salt: | not_available |
| Smiles: | C1CN(Cc2cccc(c2)Oc2ccccc2)C(c2ccc(cc2)C(F)(F)F)c2cccn2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.0626 |
| logD: | 6.8227 |
| logSw: | -6.4172 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 12.6896 |
| InChI Key: | QYNZFNDAEFLUEU-HHHXNRCGSA-N |