N-[(furan-2-yl)methyl]-1-methyl-4-({[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}amino)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-1-methyl-4-({[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}amino)-1H-pyrazole-5-carboxamide
N-[(furan-2-yl)methyl]-1-methyl-4-({[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}amino)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y502-2044 |
| Compound Name: | N-[(furan-2-yl)methyl]-1-methyl-4-({[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}amino)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 418.41 |
| Molecular Formula: | C21 H18 N6 O4 |
| Smiles: | Cn1c(C(NCc2ccco2)=O)c(cn1)/N=C/c1cccn1c1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0333 |
| logD: | 3.0324 |
| logSw: | -3.3067 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.257 |
| InChI Key: | IVBPIMPGXFFHLG-UHFFFAOYSA-N |