N-tert-butyl-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide
Chemical Structure Depiction of
N-tert-butyl-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide
N-tert-butyl-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide
Compound characteristics
| Compound ID: | 8011-7793 |
| Compound Name: | N-tert-butyl-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide |
| Molecular Weight: | 227.22 |
| Molecular Formula: | C8 H13 N5 O3 |
| Smiles: | CC(C)(C)NC(Cn1cnc(n1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7337 |
| logD: | 0.7337 |
| logSw: | -1.9278 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.201 |
| InChI Key: | DAIIDCNKYSGGLP-UHFFFAOYSA-N |