2-(4-chlorophenyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-6-carboxylic acid
Chemical Structure Depiction of
2-(4-chlorophenyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-6-carboxylic acid
2-(4-chlorophenyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-6-carboxylic acid
Compound characteristics
| Compound ID: | 3594-1018 |
| Compound Name: | 2-(4-chlorophenyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-6-carboxylic acid |
| Molecular Weight: | 351.74 |
| Molecular Formula: | C19 H10 Cl N O4 |
| Smiles: | c1cc2C(N(C(c3ccc(C(O)=O)c(c1)c23)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6385 |
| logD: | 1.7077 |
| logSw: | -4.0911 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.65 |
| InChI Key: | CMCUSAHHTJPJNG-UHFFFAOYSA-N |