N-(4-{1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-3,4-dihydroisoquinoline-2(1H)-sulfonyl}phenyl)propanamide
Chemical Structure Depiction of
N-(4-{1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-3,4-dihydroisoquinoline-2(1H)-sulfonyl}phenyl)propanamide
N-(4-{1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-3,4-dihydroisoquinoline-2(1H)-sulfonyl}phenyl)propanamide
Compound characteristics
| Compound ID: | F714-0909 |
| Compound Name: | N-(4-{1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-3,4-dihydroisoquinoline-2(1H)-sulfonyl}phenyl)propanamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C24 H29 N3 O4 S |
| Smiles: | CCC(Nc1ccc(cc1)S(N1CCc2ccccc2C1CC(N1CCCC1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1384 |
| logD: | 3.1378 |
| logSw: | -3.5068 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.561 |
| InChI Key: | WOYSMYURUKEZJY-QFIPXVFZSA-N |