N-(5-methyl-1,2-oxazol-3-yl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(5-methyl-1,2-oxazol-3-yl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
N-(5-methyl-1,2-oxazol-3-yl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
Compound ID: | C582-0890 |
Compound Name: | N-(5-methyl-1,2-oxazol-3-yl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide |
Molecular Weight: | 280.24 |
Molecular Formula: | C11 H12 N4 O5 |
Smiles: | CC(C)c1c(c(C(Nc2cc(C)on2)=O)no1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 2.6149 |
logD: | 0.8686 |
logSw: | -2.9457 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 100.715 |
InChI Key: | DLZQTRACRKRSCT-UHFFFAOYSA-N |