3-(3-acetylanilino)-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3-acetylanilino)-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione
3-(3-acetylanilino)-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0111 |
| Compound Name: | 3-(3-acetylanilino)-4-(4-chlorophenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 325.75 |
| Molecular Formula: | C18 H12 Cl N O3 |
| Smiles: | CC(c1cccc(c1)NC1=C(C(C1=O)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5184 |
| logD: | 3.5035 |
| logSw: | -3.8169 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.721 |
| InChI Key: | MAHFFLMPBAQVNW-UHFFFAOYSA-N |