methyl {5-bromo-2-methoxy-4-[(5-oxo-1-phenyl-3-propyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetate
Chemical Structure Depiction of
methyl {5-bromo-2-methoxy-4-[(5-oxo-1-phenyl-3-propyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetate
methyl {5-bromo-2-methoxy-4-[(5-oxo-1-phenyl-3-propyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetate
Compound characteristics
| Compound ID: | 5784-0363 |
| Compound Name: | methyl {5-bromo-2-methoxy-4-[(5-oxo-1-phenyl-3-propyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetate |
| Molecular Weight: | 487.35 |
| Molecular Formula: | C23 H23 Br N2 O5 |
| Smiles: | CCCC1/C(=C\c2cc(c(cc2[Br])OCC(=O)OC)OC)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4951 |
| logD: | 3.495 |
| logSw: | -3.7386 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.112 |
| InChI Key: | CWOWRWIGMXVAIZ-UHFFFAOYSA-N |