3-{[(4-chlorophenyl)methyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[(4-chlorophenyl)methyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
3-{[(4-chlorophenyl)methyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
Compound characteristics
Compound ID: | E511-0963 |
Compound Name: | 3-{[(4-chlorophenyl)methyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione |
Molecular Weight: | 339.82 |
Molecular Formula: | C20 H18 Cl N O2 |
Smiles: | CC(C)c1ccc(cc1)C1=C(C(C1=O)=O)NCc1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.6796 |
logD: | 4.6793 |
logSw: | -5.0517 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 37.216 |
InChI Key: | JRRBOCLNKVYTHY-UHFFFAOYSA-N |