3-{[2-(4-chlorophenyl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[2-(4-chlorophenyl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
3-{[2-(4-chlorophenyl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E882-0443 |
| Compound Name: | 3-{[2-(4-chlorophenyl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 353.85 |
| Molecular Formula: | C21 H20 Cl N O2 |
| Smiles: | Cc1cc(C)c(cc1C)C1=C(C(C1=O)=O)NCCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8574 |
| logD: | 4.8574 |
| logSw: | -4.703 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.058 |
| InChI Key: | NEYGMTQAZGTKAO-UHFFFAOYSA-N |