2-phenyl-7,8,9,10-tetrahydro-6H-cyclohepta[e][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
2-phenyl-7,8,9,10-tetrahydro-6H-cyclohepta[e][1,2,4]triazolo[1,5-a]pyrimidine
2-phenyl-7,8,9,10-tetrahydro-6H-cyclohepta[e][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | Y020-4523 |
| Compound Name: | 2-phenyl-7,8,9,10-tetrahydro-6H-cyclohepta[e][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 264.33 |
| Molecular Formula: | C16 H16 N4 |
| Smiles: | C1CCC2C=Nc3nc(c4ccccc4)nn3C=2CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.5716 |
| logD: | 3.5716 |
| logSw: | -3.4945 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 35.346 |
| InChI Key: | DQCMBICLFJIOGK-UHFFFAOYSA-N |