3-(5-chloro-2-methoxyanilino)-4-(3,4-dimethylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(5-chloro-2-methoxyanilino)-4-(3,4-dimethylphenyl)cyclobut-3-ene-1,2-dione
3-(5-chloro-2-methoxyanilino)-4-(3,4-dimethylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0690 |
| Compound Name: | 3-(5-chloro-2-methoxyanilino)-4-(3,4-dimethylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 341.79 |
| Molecular Formula: | C19 H16 Cl N O3 |
| Smiles: | Cc1ccc(cc1C)C1=C(C(C1=O)=O)Nc1cc(ccc1OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7243 |
| logD: | 4.621 |
| logSw: | -4.8574 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.827 |
| InChI Key: | JUKKPYVCDFEVPO-UHFFFAOYSA-N |