3-{[(4-ethoxyphenyl)methyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[(4-ethoxyphenyl)methyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
3-{[(4-ethoxyphenyl)methyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | K906-5009 |
| Compound Name: | 3-{[(4-ethoxyphenyl)methyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C22 H23 N O3 |
| Smiles: | CCOc1ccc(CNC2=C(C(C2=O)=O)c2cc(C)c(C)cc2C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5265 |
| logD: | 4.5265 |
| logSw: | -4.2786 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.34 |
| InChI Key: | WEWSBQDNGNORIT-UHFFFAOYSA-N |