(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)[1-(4-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]methanone
Chemical Structure Depiction of
(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)[1-(4-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]methanone
(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)[1-(4-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]methanone
Compound characteristics
Compound ID: | D048-0194 |
Compound Name: | (6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)[1-(4-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]methanone |
Molecular Weight: | 444.55 |
Molecular Formula: | C23 H28 N2 O5 S |
Smiles: | Cc1ccc(cc1)S(N1CCCC1C(N1CCc2cc(c(cc2C1)OC)OC)=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.8227 |
logD: | 2.8227 |
logSw: | -3.351 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 64.357 |
InChI Key: | CDCNVBIDCZGNFT-FQEVSTJZSA-N |