2-(5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-6-ethoxyphenol--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-6-ethoxyphenol--hydrogen chloride (1/1)
2-(5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-6-ethoxyphenol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8014-8717 |
| Compound Name: | 2-(5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-6-ethoxyphenol--hydrogen chloride (1/1) |
| Molecular Weight: | 356.85 |
| Molecular Formula: | C20 H20 N2 O2 |
| Salt: | HCl |
| Smiles: | CCOc1cccc(C2c3cccn3c3ccccc3CN2)c1O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7793 |
| logD: | 0.5176 |
| logSw: | -3.8133 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.734 |
| InChI Key: | VKGYRFKOXCRQAY-LJQANCHMSA-N |