2-(3-methoxypropyl)-1,3-dioxo-N-(2-oxo-2H-1-benzopyran-6-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
Chemical Structure Depiction of
2-(3-methoxypropyl)-1,3-dioxo-N-(2-oxo-2H-1-benzopyran-6-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
2-(3-methoxypropyl)-1,3-dioxo-N-(2-oxo-2H-1-benzopyran-6-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
Compound characteristics
| Compound ID: | Y042-3620 |
| Compound Name: | 2-(3-methoxypropyl)-1,3-dioxo-N-(2-oxo-2H-1-benzopyran-6-yl)-2,3-dihydro-1H-isoindole-5-carboxamide |
| Molecular Weight: | 406.39 |
| Molecular Formula: | C22 H18 N2 O6 |
| Smiles: | COCCCN1C(c2ccc(cc2C1=O)C(Nc1ccc2c(C=CC(=O)O2)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.117 |
| logD: | 2.1137 |
| logSw: | -3.1848 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.582 |
| InChI Key: | SMCQUPHBSQRHAD-UHFFFAOYSA-N |