5-(4-methylanilino)-2-oxo-3-(propan-2-yl)-3H-2lambda~5~-anthra[1,2-d][1,2,3]triazole-6,11-dione
Chemical Structure Depiction of
5-(4-methylanilino)-2-oxo-3-(propan-2-yl)-3H-2lambda~5~-anthra[1,2-d][1,2,3]triazole-6,11-dione
5-(4-methylanilino)-2-oxo-3-(propan-2-yl)-3H-2lambda~5~-anthra[1,2-d][1,2,3]triazole-6,11-dione
Compound characteristics
| Compound ID: | 8020-5558 |
| Compound Name: | 5-(4-methylanilino)-2-oxo-3-(propan-2-yl)-3H-2lambda~5~-anthra[1,2-d][1,2,3]triazole-6,11-dione |
| Molecular Weight: | 412.45 |
| Molecular Formula: | C24 H20 N4 O3 |
| Smiles: | CC(C)n1c2cc(c3C(c4ccccc4C(c3c2n[n+]1[O-])=O)=O)Nc1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5623 |
| logD: | 5.5623 |
| logSw: | -5.4872 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.691 |
| InChI Key: | RTDOVVJTMSWNBJ-UHFFFAOYSA-N |