N-benzyl-2-[3-(4-nitrophenyl)-1H-1,2,4-triazol-5-yl]acetamide
Chemical Structure Depiction of
N-benzyl-2-[3-(4-nitrophenyl)-1H-1,2,4-triazol-5-yl]acetamide
N-benzyl-2-[3-(4-nitrophenyl)-1H-1,2,4-triazol-5-yl]acetamide
Compound characteristics
| Compound ID: | 8019-9747 |
| Compound Name: | N-benzyl-2-[3-(4-nitrophenyl)-1H-1,2,4-triazol-5-yl]acetamide |
| Molecular Weight: | 337.34 |
| Molecular Formula: | C17 H15 N5 O3 |
| Smiles: | C(C(NCc1ccccc1)=O)c1nc(c2ccc(cc2)[N+]([O-])=O)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.7556 |
| logD: | 2.7467 |
| logSw: | -3.211 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.595 |
| InChI Key: | RYTNXPFBMPKLRS-UHFFFAOYSA-N |