2-(4-methoxyphenyl)-5-nitro-3-oxo-N-(2-phenylethyl)-2H-1,2,3lambda~5~-triazol-4-amine
Chemical Structure Depiction of
2-(4-methoxyphenyl)-5-nitro-3-oxo-N-(2-phenylethyl)-2H-1,2,3lambda~5~-triazol-4-amine
2-(4-methoxyphenyl)-5-nitro-3-oxo-N-(2-phenylethyl)-2H-1,2,3lambda~5~-triazol-4-amine
Compound characteristics
| Compound ID: | C437-0415 |
| Compound Name: | 2-(4-methoxyphenyl)-5-nitro-3-oxo-N-(2-phenylethyl)-2H-1,2,3lambda~5~-triazol-4-amine |
| Molecular Weight: | 355.35 |
| Molecular Formula: | C17 H17 N5 O4 |
| Smiles: | COc1ccc(cc1)n1nc(c(NCCc2ccccc2)[n+]1[O-])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9049 |
| logD: | 2.9049 |
| logSw: | -3.4185 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.791 |
| InChI Key: | QBJMPDBUCOJNOZ-UHFFFAOYSA-N |