7-amino-2-(methylsulfanyl)-5-phenyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
Chemical Structure Depiction of
7-amino-2-(methylsulfanyl)-5-phenyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
7-amino-2-(methylsulfanyl)-5-phenyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
Compound characteristics
| Compound ID: | 8525-0520F |
| Compound Name: | 7-amino-2-(methylsulfanyl)-5-phenyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile |
| Molecular Weight: | 284.34 |
| Molecular Formula: | C13 H12 N6 S |
| Smiles: | CSc1nc2NC(C(C#N)=C(N)n2n1)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7856 |
| logD: | 1.7856 |
| logSw: | -1.8282 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.374 |
| InChI Key: | OHGUMVRUHHWZBZ-SNVBAGLBSA-N |