N-methyl-2-(3-methylphenyl)-5-nitro-3-oxo-2H-1,2,3lambda~5~-triazol-4-amine
Chemical Structure Depiction of
N-methyl-2-(3-methylphenyl)-5-nitro-3-oxo-2H-1,2,3lambda~5~-triazol-4-amine
N-methyl-2-(3-methylphenyl)-5-nitro-3-oxo-2H-1,2,3lambda~5~-triazol-4-amine
Compound characteristics
| Compound ID: | C301-0396 |
| Compound Name: | N-methyl-2-(3-methylphenyl)-5-nitro-3-oxo-2H-1,2,3lambda~5~-triazol-4-amine |
| Molecular Weight: | 249.23 |
| Molecular Formula: | C10 H11 N5 O3 |
| Smiles: | Cc1cccc(c1)n1nc(c(NC)[n+]1[O-])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7238 |
| logD: | 1.7238 |
| logSw: | -1.9134 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.828 |
| InChI Key: | FDTNMAJGGLYQPZ-UHFFFAOYSA-N |