5-{[4-(1-{2-[2-(4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinylidene}ethyl)phenoxy]methyl}furan-2-carboxylic acid
Chemical Structure Depiction of
5-{[4-(1-{2-[2-(4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinylidene}ethyl)phenoxy]methyl}furan-2-carboxylic acid
5-{[4-(1-{2-[2-(4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinylidene}ethyl)phenoxy]methyl}furan-2-carboxylic acid
Compound characteristics
| Compound ID: | Y501-7307 |
| Compound Name: | 5-{[4-(1-{2-[2-(4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinylidene}ethyl)phenoxy]methyl}furan-2-carboxylic acid |
| Molecular Weight: | 441.4 |
| Molecular Formula: | C20 H19 N5 O7 |
| Smiles: | CC(C(N/N=C(/C)c1ccc(cc1)OCc1ccc(C(O)=O)o1)=O)n1cc(cn1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7755 |
| logD: | -2.2084 |
| logSw: | -1.966 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 126.282 |
| InChI Key: | IDCGCQBEEUKICZ-ZDUSSCGKSA-N |