4-{[4-(dimethylamino)phenyl]methylidene}-2-(4-iodophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[4-(dimethylamino)phenyl]methylidene}-2-(4-iodophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
4-{[4-(dimethylamino)phenyl]methylidene}-2-(4-iodophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 4357-1365 |
| Compound Name: | 4-{[4-(dimethylamino)phenyl]methylidene}-2-(4-iodophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 431.27 |
| Molecular Formula: | C19 H18 I N3 O |
| Smiles: | CC1/C(=C\c2ccc(cc2)N(C)C)C(N(c2ccc(cc2)I)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8879 |
| logD: | 4.8879 |
| logSw: | -4.6682 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 28.3915 |
| InChI Key: | LFEZBFXYVDAKDJ-UHFFFAOYSA-N |