3-(3-methoxyanilino)-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3-methoxyanilino)-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
3-(3-methoxyanilino)-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E511-0760 |
| Compound Name: | 3-(3-methoxyanilino)-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 321.37 |
| Molecular Formula: | C20 H19 N O3 |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C(C1=O)=O)Nc1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5875 |
| logD: | 4.5847 |
| logSw: | -4.3816 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.438 |
| InChI Key: | SBZLDTGLHXMUME-UHFFFAOYSA-N |