2-(3-chlorophenyl)-4-[(4-iodoanilino)methylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-4-[(4-iodoanilino)methylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
2-(3-chlorophenyl)-4-[(4-iodoanilino)methylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8005-3172 |
| Compound Name: | 2-(3-chlorophenyl)-4-[(4-iodoanilino)methylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 437.67 |
| Molecular Formula: | C17 H13 Cl I N3 O |
| Smiles: | CC1/C(=C/Nc2ccc(cc2)I)C(N(c2cccc(c2)[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1267 |
| logD: | 5.1255 |
| logSw: | -5.4581 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.188 |
| InChI Key: | NPBXMLJWMODTTK-UHFFFAOYSA-N |