9-(4-bromophenyl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
Chemical Structure Depiction of
9-(4-bromophenyl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
9-(4-bromophenyl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
Compound characteristics
| Compound ID: | D402-0075 |
| Compound Name: | 9-(4-bromophenyl)-8-(4-nitrophenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol |
| Molecular Weight: | 467.24 |
| Molecular Formula: | C18 H11 Br N8 O3 |
| Smiles: | c1cc(ccc1C1c2c(c(nnc2c2ccc(cc2)[N+]([O-])=O)O)Nc2nnnn12)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.737 |
| logD: | 2.737 |
| logSw: | -3.0127 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 123.147 |
| InChI Key: | BZQFVFFUJRHNPS-INIZCTEOSA-N |