N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-[(4-ethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-[(4-ethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)sulfanyl]acetamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-[(4-ethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F680-0338 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-[(4-ethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 436.58 |
| Molecular Formula: | C24 H28 N4 O2 S |
| Smiles: | CCN1C(C(=Nc2ccccc12)SCC(NCCCN1CCc2ccccc2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5666 |
| logD: | 1.3626 |
| logSw: | -2.7429 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.551 |
| InChI Key: | AXYSKHHFAOCFPD-UHFFFAOYSA-N |