N-(4-methoxy-2-methylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-(4-methoxy-2-methylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
N-(4-methoxy-2-methylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y500-6288 |
| Compound Name: | N-(4-methoxy-2-methylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 356.34 |
| Molecular Formula: | C17 H16 N4 O5 |
| Smiles: | Cc1cc(ccc1NC(c1ccc(Cn2cc(cn2)[N+]([O-])=O)o1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.621 |
| logD: | 2.6209 |
| logSw: | -2.861 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.904 |
| InChI Key: | FFFDCCPRUBQOQG-UHFFFAOYSA-N |