methyl 3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanoate
Chemical Structure Depiction of
methyl 3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanoate
methyl 3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanoate
Compound characteristics
| Compound ID: | Y042-8069 |
| Compound Name: | methyl 3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanoate |
| Molecular Weight: | 288.3 |
| Molecular Formula: | C15 H16 N2 O4 |
| Smiles: | COC(CCN1C([C@@H]2Cc3ccccc3CN2C1=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.4594 |
| logD: | 1.4594 |
| logSw: | -1.8915 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.448 |
| InChI Key: | RPRPQUTULGSUPS-GFCCVEGCSA-N |