3-[(1-benzylpiperidin-4-yl)amino]-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[(1-benzylpiperidin-4-yl)amino]-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione
3-[(1-benzylpiperidin-4-yl)amino]-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0133 |
| Compound Name: | 3-[(1-benzylpiperidin-4-yl)amino]-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 380.87 |
| Molecular Formula: | C22 H21 Cl N2 O2 |
| Smiles: | C1CN(CCC1NC1=C(C(C1=O)=O)c1ccc(cc1)[Cl])Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8263 |
| logD: | 2.416 |
| logSw: | -4.5322 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.482 |
| InChI Key: | RUGXYJDBWJNRNU-UHFFFAOYSA-N |