3-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[4-(propan-2-yl)phenyl]propyl}benzamide
Chemical Structure Depiction of
3-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[4-(propan-2-yl)phenyl]propyl}benzamide
3-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[4-(propan-2-yl)phenyl]propyl}benzamide
Compound characteristics
| Compound ID: | Y501-7810 |
| Compound Name: | 3-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[4-(propan-2-yl)phenyl]propyl}benzamide |
| Molecular Weight: | 406.48 |
| Molecular Formula: | C23 H26 N4 O3 |
| Smiles: | CCC(c1ccc(cc1)C(C)C)NC(c1cccc(Cn2cc(cn2)[N+]([O-])=O)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6473 |
| logD: | 4.6473 |
| logSw: | -4.2527 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.169 |
| InChI Key: | ZKXPVBFMXGXDAG-QFIPXVFZSA-N |