4-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-2-ethoxyphenol--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-2-ethoxyphenol--hydrogen chloride (1/1)
4-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-2-ethoxyphenol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8014-1563 |
| Compound Name: | 4-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-2-ethoxyphenol--hydrogen chloride (1/1) |
| Molecular Weight: | 444.96 |
| Molecular Formula: | C24 H28 N2 O4 |
| Salt: | HCl |
| Smiles: | CCOc1cc(ccc1O)C1c2cccn2c2cc(c(cc2CN1)OCC)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3163 |
| logD: | -1.1567 |
| logSw: | -3.0594 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.224 |
| InChI Key: | OXCXEWMONGDTMR-XMMPIXPASA-N |