4-[(methoxycarbonyl)amino]thiolan-3-yl 6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoate
Chemical Structure Depiction of
4-[(methoxycarbonyl)amino]thiolan-3-yl 6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoate
4-[(methoxycarbonyl)amino]thiolan-3-yl 6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoate
Compound characteristics
| Compound ID: | 8012-8010 |
| Compound Name: | 4-[(methoxycarbonyl)amino]thiolan-3-yl 6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoate |
| Molecular Weight: | 420.48 |
| Molecular Formula: | C20 H24 N2 O6 S |
| Smiles: | COC(NC1CSCC1OC(CCCCCN1C(c2ccccc2C1=O)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1992 |
| logD: | 2.1992 |
| logSw: | -2.7706 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.648 |
| InChI Key: | GBRNLKNGGALXHA-UHFFFAOYSA-N |