3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0057 |
| Compound Name: | 3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C21 H21 N O4 |
| Smiles: | Cc1ccc(cc1)C1=C(C(C1=O)=O)NCCc1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7922 |
| logD: | 2.7922 |
| logSw: | -3.324 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.319 |
| InChI Key: | QZJWAZKYNFLZNS-UHFFFAOYSA-N |