N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-4-nitroaniline
Chemical Structure Depiction of
N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-4-nitroaniline
N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-4-nitroaniline
Compound characteristics
| Compound ID: | 2023-0417 |
| Compound Name: | N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-4-nitroaniline |
| Molecular Weight: | 264.24 |
| Molecular Formula: | C11 H12 N4 O4 |
| Smiles: | Cc1c(non1)OCCNc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8244 |
| logD: | 2.8244 |
| logSw: | -3.3387 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.066 |
| InChI Key: | PNRBLPYPEGSKQR-UHFFFAOYSA-N |