2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)phenol--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)phenol--hydrogen chloride (1/1)
2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)phenol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8015-1162 |
| Compound Name: | 2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)phenol--hydrogen chloride (1/1) |
| Molecular Weight: | 400.9 |
| Molecular Formula: | C22 H24 N2 O3 |
| Salt: | HCl |
| Smiles: | CCOc1cc2CNC(c3ccccc3O)c3cccn3c2cc1OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3262 |
| logD: | 0.3254 |
| logSw: | -3.2556 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.013 |
| InChI Key: | DAPODDJDMXPSTE-JOCHJYFZSA-N |