2-methylpropyl 4-{[5-({2-[(4-fluorophenyl)acetyl]hydrazinylidene}methyl)-2-methoxyphenyl]methoxy}benzoate
Chemical Structure Depiction of
2-methylpropyl 4-{[5-({2-[(4-fluorophenyl)acetyl]hydrazinylidene}methyl)-2-methoxyphenyl]methoxy}benzoate
2-methylpropyl 4-{[5-({2-[(4-fluorophenyl)acetyl]hydrazinylidene}methyl)-2-methoxyphenyl]methoxy}benzoate
Compound characteristics
| Compound ID: | K087-0128 |
| Compound Name: | 2-methylpropyl 4-{[5-({2-[(4-fluorophenyl)acetyl]hydrazinylidene}methyl)-2-methoxyphenyl]methoxy}benzoate |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C28 H29 F N2 O5 |
| Smiles: | [H]C(\c1ccc(c(COc2ccc(cc2)C(=O)OCC(C)C)c1)OC)=N/NC(Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6534 |
| logD: | 5.6532 |
| logSw: | -5.5731 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.328 |
| InChI Key: | IBXKIYUOHVJGJR-UHFFFAOYSA-N |