N-[3-(methylsulfanyl)phenyl]-2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
N-[3-(methylsulfanyl)phenyl]-2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | F815-0392 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C20 H19 N5 O2 S2 |
| Smiles: | CSc1cccc(c1)NC(CN1C(N2C=Nc3c(C2=N1)c1CCCCc1s3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6796 |
| logD: | 3.6796 |
| logSw: | -4.2034 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.66 |
| InChI Key: | PLZTWDHJXMWRAD-UHFFFAOYSA-N |