4-(5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-2-ethoxyphenol--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-2-ethoxyphenol--hydrogen chloride (1/1)
4-(5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-2-ethoxyphenol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8013-5976 |
| Compound Name: | 4-(5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-2-ethoxyphenol--hydrogen chloride (1/1) |
| Molecular Weight: | 356.85 |
| Molecular Formula: | C20 H20 N2 O2 |
| Salt: | HCl |
| Smiles: | CCOc1cc(ccc1O)C1c2cccn2c2ccccc2CN1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3641 |
| logD: | 0.0767 |
| logSw: | -3.2129 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 37.803 |
| InChI Key: | UQNHPFXUEDWBHD-HXUWFJFHSA-N |