2-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-amine
Chemical Structure Depiction of
2-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-amine
2-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-amine
Compound characteristics
| Compound ID: | C437-0300 |
| Compound Name: | 2-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-5-nitro-3-oxo-2H-1lambda~5~,2,3-triazol-4-amine |
| Molecular Weight: | 371.35 |
| Molecular Formula: | C17 H17 N5 O5 |
| Smiles: | COc1ccc(cc1)n1nc(c(NCc2ccccc2OC)[n+]1[O-])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7696 |
| logD: | 2.7696 |
| logSw: | -3.2313 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.58 |
| InChI Key: | PSRNWCJOAZMBEA-UHFFFAOYSA-N |