4-(7,8-dihydro-2H,6H-[1,3]dioxolo[4,5-i]pyrrolo[1,2-a][1,4]benzodiazepin-8-yl)-2-methoxyphenol--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(7,8-dihydro-2H,6H-[1,3]dioxolo[4,5-i]pyrrolo[1,2-a][1,4]benzodiazepin-8-yl)-2-methoxyphenol--hydrogen chloride (1/1)
4-(7,8-dihydro-2H,6H-[1,3]dioxolo[4,5-i]pyrrolo[1,2-a][1,4]benzodiazepin-8-yl)-2-methoxyphenol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8015-2023 |
| Compound Name: | 4-(7,8-dihydro-2H,6H-[1,3]dioxolo[4,5-i]pyrrolo[1,2-a][1,4]benzodiazepin-8-yl)-2-methoxyphenol--hydrogen chloride (1/1) |
| Molecular Weight: | 386.83 |
| Molecular Formula: | C20 H18 N2 O4 |
| Salt: | HCl |
| Smiles: | COc1cc(ccc1O)C1c2cccn2c2c(CN1)ccc1c2OCO1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7825 |
| logD: | -1.4295 |
| logSw: | -2.939 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.18 |
| InChI Key: | QPBHHIBRSANBQY-GOSISDBHSA-N |