3-(2-methylanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(2-methylanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
3-(2-methylanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0097 |
| Compound Name: | 3-(2-methylanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 277.32 |
| Molecular Formula: | C18 H15 N O2 |
| Smiles: | Cc1ccc(cc1)C1=C(C(C1=O)=O)Nc1ccccc1C |
| Stereo: | ACHIRAL |
| logP: | 3.7245 |
| logD: | 3.724 |
| logSw: | -3.9497 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.197 |
| InChI Key: | YAGPMOAPVOYKIO-UHFFFAOYSA-N |