5-methyl-4-nitro-N-(1-phenylethyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
5-methyl-4-nitro-N-(1-phenylethyl)-1,2-oxazole-3-carboxamide
5-methyl-4-nitro-N-(1-phenylethyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C582-0815 |
| Compound Name: | 5-methyl-4-nitro-N-(1-phenylethyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 275.26 |
| Molecular Formula: | C13 H13 N3 O4 |
| Smiles: | CC(c1ccccc1)NC(c1c(c(C)on1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.904 |
| logD: | 1.9033 |
| logSw: | -2.2617 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.826 |
| InChI Key: | KQMKWULKLOQVCU-QMMMGPOBSA-N |