4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2425-4149 |
| Compound Name: | 4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 512.54 |
| Molecular Formula: | C27 H20 N4 O5 S |
| Smiles: | Cc1ccc(cc1)c1csc(n1)N1C(C(=C/c2ccc(c(c2)OC)O)\C(c2ccc(cc2)[N+]([O-])=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9958 |
| logD: | 5.9909 |
| logSw: | -5.3524 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.251 |
| InChI Key: | PODKKZMLVCJCRU-UHFFFAOYSA-N |