N-(4-{1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-3,4-dihydroisoquinoline-2(1H)-sulfonyl}phenyl)acetamide
Chemical Structure Depiction of
N-(4-{1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-3,4-dihydroisoquinoline-2(1H)-sulfonyl}phenyl)acetamide
N-(4-{1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-3,4-dihydroisoquinoline-2(1H)-sulfonyl}phenyl)acetamide
Compound characteristics
Compound ID: | F714-0829 |
Compound Name: | N-(4-{1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-3,4-dihydroisoquinoline-2(1H)-sulfonyl}phenyl)acetamide |
Molecular Weight: | 441.55 |
Molecular Formula: | C23 H27 N3 O4 S |
Smiles: | CC(Nc1ccc(cc1)S(N1CCc2ccccc2C1CC(N1CCCC1)=O)(=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6305 |
logD: | 2.6302 |
logSw: | -3.1794 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.674 |
InChI Key: | DVXCXSZKRRRRKN-QFIPXVFZSA-N |