4-(2H-1,3-benzodioxol-5-yl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(2H-1,3-benzodioxol-5-yl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1)
4-(2H-1,3-benzodioxol-5-yl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8013-3630 |
| Compound Name: | 4-(2H-1,3-benzodioxol-5-yl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1) |
| Molecular Weight: | 340.81 |
| Molecular Formula: | C19 H16 N2 O2 |
| Salt: | HCl |
| Smiles: | C1c2ccccc2n2cccc2C(c2ccc3c(c2)OCO3)N1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5603 |
| logD: | 0.273 |
| logSw: | -3.6626 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.1602 |
| InChI Key: | MRWBRCPVLMGQSD-LJQANCHMSA-N |