4-(4-fluoro-3-methoxyphenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(4-fluoro-3-methoxyphenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1)
4-(4-fluoro-3-methoxyphenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8015-0015 |
| Compound Name: | 4-(4-fluoro-3-methoxyphenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1) |
| Molecular Weight: | 344.81 |
| Molecular Formula: | C19 H17 F N2 O |
| Salt: | HCl |
| Smiles: | COc1cc(ccc1F)C1c2cccn2c2ccccc2CN1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7433 |
| logD: | 0.5921 |
| logSw: | -3.9797 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 21.6752 |
| InChI Key: | ADKORIBAHBCONO-LJQANCHMSA-N |