4-(4-nitrophenyl)-5,6-dihydro-4H,9H-[1,3]dioxolo[4,5-h]pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(4-nitrophenyl)-5,6-dihydro-4H,9H-[1,3]dioxolo[4,5-h]pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1)
4-(4-nitrophenyl)-5,6-dihydro-4H,9H-[1,3]dioxolo[4,5-h]pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8016-5025 |
| Compound Name: | 4-(4-nitrophenyl)-5,6-dihydro-4H,9H-[1,3]dioxolo[4,5-h]pyrrolo[1,2-a][1,4]benzodiazepine--hydrogen chloride (1/1) |
| Molecular Weight: | 385.81 |
| Molecular Formula: | C19 H15 N3 O4 |
| Salt: | HCl |
| Smiles: | C1c2cc3c(cc2n2cccc2C(c2ccc(cc2)[N+]([O-])=O)N1)OCO3 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3999 |
| logD: | 0.2688 |
| logSw: | -3.6567 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.542 |
| InChI Key: | JVTHMZUEQJNSIJ-LJQANCHMSA-N |