4-(2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl)benzamide
Chemical Structure Depiction of
4-(2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl)benzamide
4-(2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl)benzamide
Compound characteristics
| Compound ID: | 1652-1755 |
| Compound Name: | 4-(2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl)benzamide |
| Molecular Weight: | 541.54 |
| Molecular Formula: | C26 H19 N7 O5 S |
| Smiles: | COc1ccc(cc1)c1csc(n1)N1C(C(/C(c2ccc(cc2)[N+]([O-])=O)=N1)=N/Nc1ccc(cc1)C(N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9215 |
| logD: | 4.9215 |
| logSw: | -4.7776 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 130.65 |
| InChI Key: | BPSZBGJRMYWSHT-UHFFFAOYSA-N |