3-(4-anilinoanilino)-6-tert-butyl-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
3-(4-anilinoanilino)-6-tert-butyl-1,2,4-triazin-5(4H)-one
3-(4-anilinoanilino)-6-tert-butyl-1,2,4-triazin-5(4H)-one
Compound characteristics
| Compound ID: | C102-0230 |
| Compound Name: | 3-(4-anilinoanilino)-6-tert-butyl-1,2,4-triazin-5(4H)-one |
| Molecular Weight: | 335.41 |
| Molecular Formula: | C19 H21 N5 O |
| Smiles: | CC(C)(C)C1C(NC(Nc2ccc(cc2)Nc2ccccc2)=NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4834 |
| logD: | 4.4834 |
| logSw: | -4.2968 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.036 |
| InChI Key: | TVMKVKCMHKSCBC-UHFFFAOYSA-N |