3-(cycloheptylamino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(cycloheptylamino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
3-(cycloheptylamino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | K906-3952 |
| Compound Name: | 3-(cycloheptylamino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 283.37 |
| Molecular Formula: | C18 H21 N O2 |
| Smiles: | Cc1ccc(cc1)C1=C(C(C1=O)=O)NC1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.2469 |
| logD: | 4.2469 |
| logSw: | -4.1841 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.273 |
| InChI Key: | CIAPEMCJJVTYJQ-UHFFFAOYSA-N |