2,6-diamino-4-(naphthalen-1-yl)-4H-thiopyran-3,5-dicarbonitrile
Chemical Structure Depiction of
2,6-diamino-4-(naphthalen-1-yl)-4H-thiopyran-3,5-dicarbonitrile
2,6-diamino-4-(naphthalen-1-yl)-4H-thiopyran-3,5-dicarbonitrile
Compound characteristics
Compound ID: | 8008-9286 |
Compound Name: | 2,6-diamino-4-(naphthalen-1-yl)-4H-thiopyran-3,5-dicarbonitrile |
Molecular Weight: | 304.37 |
Molecular Formula: | C17 H12 N4 S |
Smiles: | C(C1C(C(C#N)=C(N)SC=1N)c1cccc2ccccc12)#N |
Stereo: | ACHIRAL |
logP: | 2.7918 |
logD: | 2.7918 |
logSw: | -3.1636 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 74.15 |
InChI Key: | YXMNNRBXIZWZAB-UHFFFAOYSA-N |