5-[(3S)-1,2-dithiolan-3-yl]-N-[2-(3-hydroxy-2-oxoquinoxalin-1(2H)-yl)ethyl]pentanamide
Chemical Structure Depiction of
5-[(3S)-1,2-dithiolan-3-yl]-N-[2-(3-hydroxy-2-oxoquinoxalin-1(2H)-yl)ethyl]pentanamide
5-[(3S)-1,2-dithiolan-3-yl]-N-[2-(3-hydroxy-2-oxoquinoxalin-1(2H)-yl)ethyl]pentanamide
Compound characteristics
| Compound ID: | Y043-2972 |
| Compound Name: | 5-[(3S)-1,2-dithiolan-3-yl]-N-[2-(3-hydroxy-2-oxoquinoxalin-1(2H)-yl)ethyl]pentanamide |
| Molecular Weight: | 393.53 |
| Molecular Formula: | C18 H23 N3 O3 S2 |
| Smiles: | C(CC[C@H]1CCSS1)CC(NCCN1C(C(=Nc2ccccc12)O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.5883 |
| logD: | 1.5304 |
| logSw: | -2.1625 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.557 |
| InChI Key: | LJSIRYBWAMTTSH-ZDUSSCGKSA-N |