1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-nitrophenyl)ethan-1-one
Chemical Structure Depiction of
1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-nitrophenyl)ethan-1-one
1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-nitrophenyl)ethan-1-one
Compound characteristics
| Compound ID: | 3852-0542 |
| Compound Name: | 1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-nitrophenyl)ethan-1-one |
| Molecular Weight: | 432.27 |
| Molecular Formula: | C19 H18 Br N3 O4 |
| Smiles: | CCC1CC(c2ccc(cc2)[Br])(N(C(Cc2ccc(cc2)[N+]([O-])=O)=O)N=1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1416 |
| logD: | 4.1416 |
| logSw: | -4.2265 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.276 |
| InChI Key: | VDUYGFTYAXNXLA-IBGZPJMESA-N |