2-(3-nitro-1H-1,2,4-triazol-1-yl)-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-(3-nitro-1H-1,2,4-triazol-1-yl)-N-(2-phenylethyl)acetamide
2-(3-nitro-1H-1,2,4-triazol-1-yl)-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | 8004-9575 |
| Compound Name: | 2-(3-nitro-1H-1,2,4-triazol-1-yl)-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 275.26 |
| Molecular Formula: | C12 H13 N5 O3 |
| Smiles: | C(CNC(Cn1cnc(n1)[N+]([O-])=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 0.6758 |
| logD: | 0.6758 |
| logSw: | -2.1933 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.947 |
| InChI Key: | AGXFMSVEPSNBAN-UHFFFAOYSA-N |