2-nitro-N-[(oxolan-2-yl)methyl]-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
Chemical Structure Depiction of
2-nitro-N-[(oxolan-2-yl)methyl]-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
2-nitro-N-[(oxolan-2-yl)methyl]-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline
Compound characteristics
| Compound ID: | D349-3608 |
| Compound Name: | 2-nitro-N-[(oxolan-2-yl)methyl]-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]aniline |
| Molecular Weight: | 332.36 |
| Molecular Formula: | C16 H20 N4 O4 |
| Smiles: | CC(C)c1nc(c2ccc(c(c2)[N+]([O-])=O)NCC2CCCO2)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.174 |
| logD: | 3.174 |
| logSw: | -3.5237 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.187 |
| InChI Key: | BUPJBFLXKWEKEY-GFCCVEGCSA-N |