9-(4-hydroxy-3-methoxyphenyl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
Chemical Structure Depiction of
9-(4-hydroxy-3-methoxyphenyl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
9-(4-hydroxy-3-methoxyphenyl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
Compound characteristics
| Compound ID: | D402-0083 |
| Compound Name: | 9-(4-hydroxy-3-methoxyphenyl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol |
| Molecular Weight: | 434.37 |
| Molecular Formula: | C19 H14 N8 O5 |
| Smiles: | COc1cc(ccc1O)C1c2c(c(nnc2c2ccc(cc2)[N+]([O-])=O)O)Nc2nnnn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1489 |
| logD: | 1.1489 |
| logSw: | -2.0929 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 147.325 |
| InChI Key: | UMDPFXMWAWLKDJ-KRWDZBQOSA-N |