2-chloro-N-{3-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propyl}-4-nitroaniline
Chemical Structure Depiction of
2-chloro-N-{3-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propyl}-4-nitroaniline
2-chloro-N-{3-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propyl}-4-nitroaniline
Compound characteristics
| Compound ID: | 8010-6560 |
| Compound Name: | 2-chloro-N-{3-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propyl}-4-nitroaniline |
| Molecular Weight: | 312.71 |
| Molecular Formula: | C12 H13 Cl N4 O4 |
| Smiles: | Cc1c(non1)OCCCNc1ccc(cc1[Cl])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5381 |
| logD: | 3.5381 |
| logSw: | -3.7454 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.368 |
| InChI Key: | JMDGWNZNEMVRMI-UHFFFAOYSA-N |