2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-3-methoxyphenol--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)-3-methoxyphenol--hydrogen chloride (1/1)
2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-3-methoxyphenol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8015-2152 |
| Compound Name: | 2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-3-methoxyphenol--hydrogen chloride (1/1) |
| Molecular Weight: | 430.93 |
| Molecular Formula: | C23 H26 N2 O4 |
| Salt: | HCl |
| Smiles: | CCOc1cc2CNC(c3c(cccc3OC)O)c3cccn3c2cc1OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2497 |
| logD: | 0.2243 |
| logSw: | -3.0699 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.644 |
| InChI Key: | YUDFNRUFPQHGDK-QHCPKHFHSA-N |