4-[(3-hydroxyanilino)methylidene]-2-(4-iodophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(3-hydroxyanilino)methylidene]-2-(4-iodophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
4-[(3-hydroxyanilino)methylidene]-2-(4-iodophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y508-6705 |
| Compound Name: | 4-[(3-hydroxyanilino)methylidene]-2-(4-iodophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 419.22 |
| Molecular Formula: | C17 H14 I N3 O2 |
| Smiles: | CC1/C(=C/Nc2cccc(c2)O)C(N(c2ccc(cc2)I)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.745 |
| logD: | 3.7431 |
| logSw: | -3.7105 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.805 |
| InChI Key: | OCVSUPOGXFXWQP-UHFFFAOYSA-N |