5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N'-{[5-(4-nitrophenyl)furan-2-yl]methylidene}furan-2-carbohydrazide
Chemical Structure Depiction of
5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N'-{[5-(4-nitrophenyl)furan-2-yl]methylidene}furan-2-carbohydrazide
5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N'-{[5-(4-nitrophenyl)furan-2-yl]methylidene}furan-2-carbohydrazide
Compound characteristics
| Compound ID: | Y500-6546 |
| Compound Name: | 5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N'-{[5-(4-nitrophenyl)furan-2-yl]methylidene}furan-2-carbohydrazide |
| Molecular Weight: | 433.42 |
| Molecular Formula: | C22 H19 N5 O5 |
| Smiles: | Cc1cc(C)n(Cc2ccc(C(N/N=C/c3ccc(c4ccc(cc4)[N+]([O-])=O)o3)=O)o2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.9583 |
| logD: | 3.9581 |
| logSw: | -4.0402 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.082 |
| InChI Key: | XMDCFXNTELLNKR-UHFFFAOYSA-N |