6-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropane-1-sulfonyl]-1,4-dimethyl-1,4-dihydroquinoxaline-2,3-dione
Chemical Structure Depiction of
6-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropane-1-sulfonyl]-1,4-dimethyl-1,4-dihydroquinoxaline-2,3-dione
6-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropane-1-sulfonyl]-1,4-dimethyl-1,4-dihydroquinoxaline-2,3-dione
Compound characteristics
| Compound ID: | C920-1161 |
| Compound Name: | 6-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropane-1-sulfonyl]-1,4-dimethyl-1,4-dihydroquinoxaline-2,3-dione |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C22 H23 N3 O5 S |
| Smiles: | CN1C(C(N(C)c2cc(ccc12)S(CCC(N1CCc2ccccc2C1)=O)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7417 |
| logD: | 0.7417 |
| logSw: | -2.2642 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.417 |
| InChI Key: | HRDBWMSMNHCLLW-UHFFFAOYSA-N |