3-[1',5'-dimethyl-2-(4-nitrophenyl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-5-yl]phenol
Chemical Structure Depiction of
3-[1',5'-dimethyl-2-(4-nitrophenyl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-5-yl]phenol
3-[1',5'-dimethyl-2-(4-nitrophenyl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-5-yl]phenol
Compound characteristics
| Compound ID: | Y505-7227 |
| Compound Name: | 3-[1',5'-dimethyl-2-(4-nitrophenyl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-5-yl]phenol |
| Molecular Weight: | 377.4 |
| Molecular Formula: | C20 H19 N5 O3 |
| Smiles: | Cc1c(cnn1C)C1CC(c2cccc(c2)O)=NN1c1ccc(cc1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6454 |
| logD: | 3.6449 |
| logSw: | -3.5911 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.404 |
| InChI Key: | SMFBZKWVKOHAEQ-FQEVSTJZSA-N |