(azepan-1-yl)(5-methyl-4-nitro-1,2-oxazol-3-yl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(5-methyl-4-nitro-1,2-oxazol-3-yl)methanone
(azepan-1-yl)(5-methyl-4-nitro-1,2-oxazol-3-yl)methanone
Compound characteristics
| Compound ID: | C582-0808 |
| Compound Name: | (azepan-1-yl)(5-methyl-4-nitro-1,2-oxazol-3-yl)methanone |
| Molecular Weight: | 253.25 |
| Molecular Formula: | C11 H15 N3 O4 |
| Smiles: | Cc1c(c(C(N2CCCCCC2)=O)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7373 |
| logD: | 1.7373 |
| logSw: | -1.6867 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.229 |
| InChI Key: | GZWJWRXSXIYRAI-UHFFFAOYSA-N |