3-(4-methylphenyl)-4-{[(pyridin-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-methylphenyl)-4-{[(pyridin-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
3-(4-methylphenyl)-4-{[(pyridin-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0025 |
| Compound Name: | 3-(4-methylphenyl)-4-{[(pyridin-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 278.31 |
| Molecular Formula: | C17 H14 N2 O2 |
| Smiles: | Cc1ccc(cc1)C1=C(C(C1=O)=O)NCc1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 2.2602 |
| logD: | 2.2601 |
| logSw: | -2.5516 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.76 |
| InChI Key: | WXGAWOGMIVXUFC-UHFFFAOYSA-N |