9-(furan-2-yl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
Chemical Structure Depiction of
9-(furan-2-yl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
9-(furan-2-yl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
Compound characteristics
| Compound ID: | D402-0087 |
| Compound Name: | 9-(furan-2-yl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol |
| Molecular Weight: | 378.3 |
| Molecular Formula: | C16 H10 N8 O4 |
| Smiles: | c1cc(C2c3c(c(nnc3c3ccc(cc3)[N+]([O-])=O)O)Nc3nnnn23)oc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1041 |
| logD: | -1.5303 |
| logSw: | -1.8856 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 131.725 |
| InChI Key: | LFBUGSVHCILXRS-AWEZNQCLSA-N |