ethyl 4-(7,8-dimethoxy-1-oxo-3-sulfanylidene-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl)benzoate
Chemical Structure Depiction of
ethyl 4-(7,8-dimethoxy-1-oxo-3-sulfanylidene-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl)benzoate
ethyl 4-(7,8-dimethoxy-1-oxo-3-sulfanylidene-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl)benzoate
Compound characteristics
| Compound ID: | 8249-4001 |
| Compound Name: | ethyl 4-(7,8-dimethoxy-1-oxo-3-sulfanylidene-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl)benzoate |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C22 H22 N2 O5 S |
| Smiles: | CCOC(c1ccc(cc1)N1C(C2Cc3cc(c(cc3CN2C1=S)OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0021 |
| logD: | 3.0021 |
| logSw: | -3.2239 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 54.715 |
| InChI Key: | LKSJZPRTSYDNJA-QGZVFWFLSA-N |