N-(4-butylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-(4-butylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
N-(4-butylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y501-3999 |
| Compound Name: | N-(4-butylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 368.39 |
| Molecular Formula: | C19 H20 N4 O4 |
| Smiles: | CCCCc1ccc(cc1)NC(c1ccc(Cn2cc(cn2)[N+]([O-])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3625 |
| logD: | 4.3625 |
| logSw: | -4.1952 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.058 |
| InChI Key: | AVVNVIJPLOFDOL-UHFFFAOYSA-N |