ethyl (4-bromo-2-{[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetate
Chemical Structure Depiction of
ethyl (4-bromo-2-{[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetate
ethyl (4-bromo-2-{[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetate
Compound characteristics
| Compound ID: | Y010-1578 |
| Compound Name: | ethyl (4-bromo-2-{[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetate |
| Molecular Weight: | 477.74 |
| Molecular Formula: | C21 H18 Br Cl N2 O4 |
| Smiles: | CCOC(COc1ccc(cc1/C=C1/C(C)=NN(C1=O)c1cccc(c1)[Cl])[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9331 |
| logD: | 4.9331 |
| logSw: | -4.8824 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.331 |
| InChI Key: | OMZKSYWJFZEWLS-UHFFFAOYSA-N |