4,4'-[(5-bromo-3-ethoxy-2-hydroxyphenyl)methylene]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Chemical Structure Depiction of
4,4'-[(5-bromo-3-ethoxy-2-hydroxyphenyl)methylene]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
4,4'-[(5-bromo-3-ethoxy-2-hydroxyphenyl)methylene]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Compound characteristics
| Compound ID: | 1348-1805 |
| Compound Name: | 4,4'-[(5-bromo-3-ethoxy-2-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(C(C2=C(C)N(C)N(C2=O)c2ccccc2)C2=C(C)N(C)N(C2=O)c2ccccc2)c1O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.364 |
| logD: | 4.3625 |
| logSw: | -4.1722 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.749 |
| InChI Key: | PEOMLICSCKXIDT-UHFFFAOYSA-N |