5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-methylfuran-2-carboxamide
Chemical Structure Depiction of
5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-methylfuran-2-carboxamide
5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-methylfuran-2-carboxamide
Compound characteristics
| Compound ID: | Y500-1570 |
| Compound Name: | 5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-methylfuran-2-carboxamide |
| Molecular Weight: | 414.46 |
| Molecular Formula: | C20 H26 N6 O4 |
| Smiles: | CCn1c(C)c(CN(C)C(c2ccc(Cn3c(C)c(c(C)n3)[N+]([O-])=O)o2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.5186 |
| logD: | 1.5186 |
| logSw: | -2.0146 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 85.57 |
| InChI Key: | ALFCPQYRLUWSPE-UHFFFAOYSA-N |