2-(naphthalen-1-yl)-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-(naphthalen-1-yl)-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-(naphthalen-1-yl)-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | 4072-2807 |
| Compound Name: | 2-(naphthalen-1-yl)-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 370.47 |
| Molecular Formula: | C22 H18 N4 S |
| Smiles: | C1CCc2c3c4nc(c5cccc6ccccc56)nn4C=Nc3sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.3519 |
| logD: | 5.3502 |
| logSw: | -6.7471 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 33.635 |
| InChI Key: | RKNBAQMBADLIBT-UHFFFAOYSA-N |