N-[(4-methoxyphenyl)methyl]-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
N-[(4-methoxyphenyl)methyl]-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C582-0816 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-5-methyl-4-nitro-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 291.26 |
| Molecular Formula: | C13 H13 N3 O5 |
| Smiles: | Cc1c(c(C(NCc2ccc(cc2)OC)=O)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.664 |
| logD: | 1.6639 |
| logSw: | -2.1255 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.207 |
| InChI Key: | WRYBHWQUCWLFOW-UHFFFAOYSA-N |