5-(4-methylanilino)-3-phenyl-3H-anthra[1,2-d][1,2,3]triazole-6,11-dione
Chemical Structure Depiction of
5-(4-methylanilino)-3-phenyl-3H-anthra[1,2-d][1,2,3]triazole-6,11-dione
5-(4-methylanilino)-3-phenyl-3H-anthra[1,2-d][1,2,3]triazole-6,11-dione
Compound characteristics
| Compound ID: | 8013-0566 |
| Compound Name: | 5-(4-methylanilino)-3-phenyl-3H-anthra[1,2-d][1,2,3]triazole-6,11-dione |
| Molecular Weight: | 430.47 |
| Molecular Formula: | C27 H18 N4 O2 |
| Smiles: | Cc1ccc(cc1)Nc1cc2c(c3C(c4ccccc4C(c13)=O)=O)nnn2c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.4311 |
| logD: | 6.4311 |
| logSw: | -5.7283 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.728 |
| InChI Key: | ASQSDTVXUSDDHR-UHFFFAOYSA-N |