N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carboxamide
Compound characteristics
| Compound ID: | C447-0516 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carboxamide |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C20 H20 N2 O4 |
| Smiles: | CCCN1Cc2cccc(C(NCc3ccc4c(c3)OCO4)=O)c2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.0381 |
| logD: | 3.0381 |
| logSw: | -3.4334 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.664 |
| InChI Key: | MYAPBPMHUFNXOP-UHFFFAOYSA-N |