2,2'-(5-{[4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl]carbamoyl}-1,3-phenylene)bis(1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid)
Chemical Structure Depiction of
2,2'-(5-{[4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl]carbamoyl}-1,3-phenylene)bis(1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid)
2,2'-(5-{[4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl]carbamoyl}-1,3-phenylene)bis(1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid)
Compound characteristics
| Compound ID: | 8004-9038 |
| Compound Name: | 2,2'-(5-{[4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl]carbamoyl}-1,3-phenylene)bis(1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid) |
| Molecular Weight: | 705.64 |
| Molecular Formula: | C40 H23 N3 O10 |
| Smiles: | C(=C/c1ccc(cc1)NC(c1cc(cc(c1)N1C(c2ccc(cc2C1=O)C(O)=O)=O)N1C(c2ccc(cc2C1=O)C(O)=O)=O)=O)\C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3201 |
| logD: | 2.3426 |
| logSw: | -5.9082 |
| Hydrogen bond acceptors count: | 18 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 150.404 |
| InChI Key: | WJWRDBNAUIUGIE-UHFFFAOYSA-N |