ethyl 4-(5-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate
Chemical Structure Depiction of
ethyl 4-(5-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate
ethyl 4-(5-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate
Compound characteristics
| Compound ID: | 3448-3304 |
| Compound Name: | ethyl 4-(5-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate |
| Molecular Weight: | 486.48 |
| Molecular Formula: | C27 H22 N2 O7 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1ccc2C(N(C(c2c1)=O)c1ccc(cc1)C(=O)OCC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0198 |
| logD: | 4.9842 |
| logSw: | -4.562 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.478 |
| InChI Key: | BKMRVMYJPXUYJT-UHFFFAOYSA-N |