3-{[(4-chlorophenyl)methyl]amino}-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[(4-chlorophenyl)methyl]amino}-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione
3-{[(4-chlorophenyl)methyl]amino}-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-1033 |
| Compound Name: | 3-{[(4-chlorophenyl)methyl]amino}-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 327.77 |
| Molecular Formula: | C18 H14 Cl N O3 |
| Smiles: | COc1ccc(cc1)C1=C(C(C1=O)=O)NCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3238 |
| logD: | 3.3235 |
| logSw: | -3.7728 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.76 |
| InChI Key: | KDXKTBGSUVEPGM-UHFFFAOYSA-N |