N,2-bis(4-methoxyphenyl)-4,6-dinitro-1-oxo-2H-1lambda~5~-indazol-3-amine
Chemical Structure Depiction of
N,2-bis(4-methoxyphenyl)-4,6-dinitro-1-oxo-2H-1lambda~5~-indazol-3-amine
N,2-bis(4-methoxyphenyl)-4,6-dinitro-1-oxo-2H-1lambda~5~-indazol-3-amine
Compound characteristics
| Compound ID: | 8010-5067 |
| Compound Name: | N,2-bis(4-methoxyphenyl)-4,6-dinitro-1-oxo-2H-1lambda~5~-indazol-3-amine |
| Molecular Weight: | 451.39 |
| Molecular Formula: | C21 H17 N5 O7 |
| Smiles: | COc1ccc(cc1)Nc1c2c(cc(cc2[n+](n1c1ccc(cc1)OC)[O-])[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6888 |
| logD: | 4.6888 |
| logSw: | -4.8216 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.404 |
| InChI Key: | ZPLUCEZCHGGTDA-UHFFFAOYSA-N |