5-amino-2-{[(2-chlorophenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
Chemical Structure Depiction of
5-amino-2-{[(2-chlorophenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
5-amino-2-{[(2-chlorophenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile
Compound characteristics
| Compound ID: | Y020-7648 |
| Compound Name: | 5-amino-2-{[(2-chlorophenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonitrile |
| Molecular Weight: | 316.77 |
| Molecular Formula: | C13 H9 Cl N6 S |
| Smiles: | C(c1ccccc1[Cl])Sc1nc2nc(c(C#N)cn2n1)N |
| Stereo: | ACHIRAL |
| logP: | 2.4188 |
| logD: | 2.4188 |
| logSw: | -3.274 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.521 |
| InChI Key: | YETQNVGFDRRMNJ-UHFFFAOYSA-N |