4,4'-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylene]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Chemical Structure Depiction of
4,4'-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylene]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
4,4'-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylene]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Compound characteristics
| Compound ID: | 2049-1621 |
| Compound Name: | 4,4'-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylene]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one) |
| Molecular Weight: | 603.52 |
| Molecular Formula: | C31 H31 Br N4 O4 |
| Smiles: | CCOc1cc(cc(c1O)[Br])C(C1=C(C)N(C)N(C1=O)c1ccccc1)C1=C(C)N(C)N(C1=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8105 |
| logD: | 3.8065 |
| logSw: | -3.7821 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.749 |
| InChI Key: | IOWUBWBSTMONTO-UHFFFAOYSA-N |