2-{[1-(2,3-difluorophenyl)-4,5-dihydro-1H-pyrrolo[1,2-a][1,4]diazepin-2(3H)-yl]methyl}-4-methylphenol
Chemical Structure Depiction of
2-{[1-(2,3-difluorophenyl)-4,5-dihydro-1H-pyrrolo[1,2-a][1,4]diazepin-2(3H)-yl]methyl}-4-methylphenol
2-{[1-(2,3-difluorophenyl)-4,5-dihydro-1H-pyrrolo[1,2-a][1,4]diazepin-2(3H)-yl]methyl}-4-methylphenol
Compound characteristics
| Compound ID: | V022-4323 |
| Compound Name: | 2-{[1-(2,3-difluorophenyl)-4,5-dihydro-1H-pyrrolo[1,2-a][1,4]diazepin-2(3H)-yl]methyl}-4-methylphenol |
| Molecular Weight: | 368.43 |
| Molecular Formula: | C22 H22 F2 N2 O |
| Smiles: | Cc1ccc(c(CN2CCCn3cccc3C2c2cccc(c2F)F)c1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8379 |
| logD: | 4.8314 |
| logSw: | -4.2863 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.4899 |
| InChI Key: | BUAHOJURNWTSPI-JOCHJYFZSA-N |