3-(cyclooctylamino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(cyclooctylamino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
3-(cyclooctylamino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0050 |
| Compound Name: | 3-(cyclooctylamino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 297.4 |
| Molecular Formula: | C19 H23 N O2 |
| Smiles: | Cc1ccc(cc1)C1=C(C(C1=O)=O)NC1CCCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.7428 |
| logD: | 4.7428 |
| logSw: | -4.489 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.273 |
| InChI Key: | AESTXIVJJXNTJI-UHFFFAOYSA-N |