N-tert-butyl-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
N-tert-butyl-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C582-0934 |
| Compound Name: | N-tert-butyl-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 255.27 |
| Molecular Formula: | C11 H17 N3 O4 |
| Smiles: | CC(C)c1c(c(C(NC(C)(C)C)=O)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5115 |
| logD: | 2.5115 |
| logSw: | -2.6333 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.337 |
| InChI Key: | VRTHHLKNSIVFDS-UHFFFAOYSA-N |