2-{[(naphthalen-1-yl)oxy]methyl}-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)oxy]methyl}-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)oxy]methyl}-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: | 4072-2808 |
| Compound Name: | 2-{[(naphthalen-1-yl)oxy]methyl}-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C23 H20 N4 O S |
| Smiles: | C1CCc2c3c4nc(COc5cccc6ccccc56)nn4C=Nc3sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.6495 |
| logD: | 5.6477 |
| logSw: | -6.946 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.212 |
| InChI Key: | IHPOCHPLIMIFDH-UHFFFAOYSA-N |