5-methyl-4-nitro-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
5-methyl-4-nitro-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide
5-methyl-4-nitro-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C582-0805 |
| Compound Name: | 5-methyl-4-nitro-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 275.26 |
| Molecular Formula: | C13 H13 N3 O4 |
| Smiles: | Cc1c(c(C(NCCc2ccccc2)=O)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.6151 |
| logD: | 1.6151 |
| logSw: | -2.0442 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.505 |
| InChI Key: | RKQHCSKIDYHGEE-UHFFFAOYSA-N |