3-(3,4-dimethylphenyl)-4-[(2-methylbutan-2-yl)amino]cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3,4-dimethylphenyl)-4-[(2-methylbutan-2-yl)amino]cyclobut-3-ene-1,2-dione
3-(3,4-dimethylphenyl)-4-[(2-methylbutan-2-yl)amino]cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0677 |
| Compound Name: | 3-(3,4-dimethylphenyl)-4-[(2-methylbutan-2-yl)amino]cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 271.36 |
| Molecular Formula: | C17 H21 N O2 |
| Smiles: | CCC(C)(C)NC1=C(C(C1=O)=O)c1ccc(C)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8671 |
| logD: | 3.867 |
| logSw: | -3.8818 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.779 |
| InChI Key: | PVDMPLMQKIYGJO-UHFFFAOYSA-N |