8-(4-methylphenyl)-6,7,8,13-tetrahydro-5H-benzo[6,7]cyclohepta[1,2-d][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
8-(4-methylphenyl)-6,7,8,13-tetrahydro-5H-benzo[6,7]cyclohepta[1,2-d][1,2,4]triazolo[1,5-a]pyrimidine
8-(4-methylphenyl)-6,7,8,13-tetrahydro-5H-benzo[6,7]cyclohepta[1,2-d][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | C202-3716 |
| Compound Name: | 8-(4-methylphenyl)-6,7,8,13-tetrahydro-5H-benzo[6,7]cyclohepta[1,2-d][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 328.42 |
| Molecular Formula: | C21 H20 N4 |
| Smiles: | Cc1ccc(cc1)C1C2CCCc3ccccc3C=2Nc2ncnn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6829 |
| logD: | 4.6814 |
| logSw: | -4.5465 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.527 |
| InChI Key: | CNFSJCQJHBABBG-HXUWFJFHSA-N |