3-[(2,3-dimethylcyclohexyl)amino]-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[(2,3-dimethylcyclohexyl)amino]-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
3-[(2,3-dimethylcyclohexyl)amino]-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E882-0542 |
| Compound Name: | 3-[(2,3-dimethylcyclohexyl)amino]-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 325.45 |
| Molecular Formula: | C21 H27 N O2 |
| Smiles: | CC1CCCC(C1C)NC1=C(C(C1=O)=O)c1cc(C)c(C)cc1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8015 |
| logD: | 4.8015 |
| logSw: | -4.4759 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.332 |
| InChI Key: | GLONKYQLORTCLR-UHFFFAOYSA-N |