2-(4-methoxyphenyl)-5-nitro-3-oxo-N-[4-(propan-2-yl)phenyl]-2H-1lambda~5~,2,3-triazol-4-amine
Chemical Structure Depiction of
2-(4-methoxyphenyl)-5-nitro-3-oxo-N-[4-(propan-2-yl)phenyl]-2H-1lambda~5~,2,3-triazol-4-amine
2-(4-methoxyphenyl)-5-nitro-3-oxo-N-[4-(propan-2-yl)phenyl]-2H-1lambda~5~,2,3-triazol-4-amine
Compound characteristics
| Compound ID: | C437-0272 |
| Compound Name: | 2-(4-methoxyphenyl)-5-nitro-3-oxo-N-[4-(propan-2-yl)phenyl]-2H-1lambda~5~,2,3-triazol-4-amine |
| Molecular Weight: | 369.38 |
| Molecular Formula: | C18 H19 N5 O4 |
| Smiles: | CC(C)c1ccc(cc1)Nc1c(nn(c2ccc(cc2)OC)[n+]1[O-])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3167 |
| logD: | 4.3167 |
| logSw: | -4.3461 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.627 |
| InChI Key: | KYVKXFGMGUYVTL-UHFFFAOYSA-N |