2-[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]-4-oxo-4H-3,1-benzoxazin-6-yl acetate
Chemical Structure Depiction of
2-[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]-4-oxo-4H-3,1-benzoxazin-6-yl acetate
2-[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]-4-oxo-4H-3,1-benzoxazin-6-yl acetate
Compound characteristics
| Compound ID: | 5930-0601 |
| Compound Name: | 2-[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]-4-oxo-4H-3,1-benzoxazin-6-yl acetate |
| Molecular Weight: | 406.39 |
| Molecular Formula: | C22 H18 N2 O6 |
| Smiles: | CC(C)CN1C(c2ccc(cc2C1=O)C1=Nc2ccc(cc2C(=O)O1)OC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8009 |
| logD: | 2.8009 |
| logSw: | -3.4465 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.461 |
| InChI Key: | RDFRABBPWHHEQX-UHFFFAOYSA-N |