N~1~-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-N~2~-(2-nitrophenyl)ethane-1,2-diamine
Chemical Structure Depiction of
N~1~-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-N~2~-(2-nitrophenyl)ethane-1,2-diamine
N~1~-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-N~2~-(2-nitrophenyl)ethane-1,2-diamine
Compound characteristics
| Compound ID: | 2023-0376 |
| Compound Name: | N~1~-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-N~2~-(2-nitrophenyl)ethane-1,2-diamine |
| Molecular Weight: | 307.31 |
| Molecular Formula: | C13 H17 N5 O4 |
| Smiles: | Cc1c(non1)OCCNCCNc1ccccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.817 |
| logD: | -0.3773 |
| logSw: | -1.856 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.788 |
| InChI Key: | BLKKBTRIZZEWLJ-UHFFFAOYSA-N |