9-(4-nitrophenyl)-8-(thiophen-2-yl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
Chemical Structure Depiction of
9-(4-nitrophenyl)-8-(thiophen-2-yl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
9-(4-nitrophenyl)-8-(thiophen-2-yl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
Compound characteristics
| Compound ID: | D402-0218 |
| Compound Name: | 9-(4-nitrophenyl)-8-(thiophen-2-yl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol |
| Molecular Weight: | 394.37 |
| Molecular Formula: | C16 H10 N8 O3 S |
| Smiles: | c1cc(c2c3C(c4ccc(cc4)[N+]([O-])=O)n4c(Nc3c(nn2)O)nnn4)sc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8523 |
| logD: | 1.8523 |
| logSw: | -2.255 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 124.165 |
| InChI Key: | DZCUHGCDKCKPKJ-AWEZNQCLSA-N |