N~1~-(2-chloro-4-nitrophenyl)-N~2~-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}ethane-1,2-diamine
Chemical Structure Depiction of
N~1~-(2-chloro-4-nitrophenyl)-N~2~-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}ethane-1,2-diamine
N~1~-(2-chloro-4-nitrophenyl)-N~2~-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}ethane-1,2-diamine
Compound characteristics
| Compound ID: | 8010-1508 |
| Compound Name: | N~1~-(2-chloro-4-nitrophenyl)-N~2~-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}ethane-1,2-diamine |
| Molecular Weight: | 341.75 |
| Molecular Formula: | C13 H16 Cl N5 O4 |
| Smiles: | Cc1c(non1)OCCNCCNc1ccc(cc1[Cl])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4501 |
| logD: | 0.6487 |
| logSw: | -3.409 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.089 |
| InChI Key: | NHHGMLMHEKPEIK-UHFFFAOYSA-N |