3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E882-0586 |
| Compound Name: | 3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C25 H29 N O4 |
| Smiles: | CCOc1ccc(CCNC2=C(C(C2=O)=O)c2cc(C)c(C)cc2C)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.271 |
| logD: | 4.271 |
| logSw: | -4.2267 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.479 |
| InChI Key: | YZHHYAYSJWYXGS-UHFFFAOYSA-N |