3-(cyclooctylamino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(cyclooctylamino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
3-(cyclooctylamino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E882-0447 |
| Compound Name: | 3-(cyclooctylamino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 325.45 |
| Molecular Formula: | C21 H27 N O2 |
| Smiles: | Cc1cc(C)c(cc1C)C1=C(C(C1=O)=O)NC1CCCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.7304 |
| logD: | 5.7304 |
| logSw: | -5.3089 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.273 |
| InChI Key: | APOVEWXULZARAS-UHFFFAOYSA-N |