3-[(butan-2-yl)amino]-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[(butan-2-yl)amino]-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
3-[(butan-2-yl)amino]-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0038 |
| Compound Name: | 3-[(butan-2-yl)amino]-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 243.3 |
| Molecular Formula: | C15 H17 N O2 |
| Smiles: | CCC(C)NC1=C(C(C1=O)=O)c1ccc(C)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9826 |
| logD: | 2.9825 |
| logSw: | -3.2347 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.93 |
| InChI Key: | OBHLOOKIVWMVSK-JTQLQIEISA-N |