2-(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol
Chemical Structure Depiction of
2-(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol
2-(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol
Compound characteristics
| Compound ID: | 4072-2782 |
| Compound Name: | 2-(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol |
| Molecular Weight: | 336.41 |
| Molecular Formula: | C18 H16 N4 O S |
| Smiles: | C1CCc2c3c4nc(c5ccccc5O)nn4C=Nc3sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.6112 |
| logD: | 4.5718 |
| logSw: | -4.0383 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.455 |
| InChI Key: | UCCLDWOWYXGBCN-UHFFFAOYSA-N |