N-[3-(methylsulfanyl)phenyl]-2-(4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-(4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)acetamide
N-[3-(methylsulfanyl)phenyl]-2-(4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)acetamide
Compound characteristics
| Compound ID: | E228-0147 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-(4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)acetamide |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C20 H17 N3 O2 S |
| Smiles: | CSc1cccc(c1)NC(CN1C(c2cccn2c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.823 |
| logD: | 3.823 |
| logSw: | -3.9859 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.115 |
| InChI Key: | AXAORPZGPVOZKC-UHFFFAOYSA-N |