5,7-dimethyl-3-[(2-phenylethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidine
Chemical Structure Depiction of
5,7-dimethyl-3-[(2-phenylethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidine
5,7-dimethyl-3-[(2-phenylethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidine
Compound characteristics
| Compound ID: | 4065-0394 |
| Compound Name: | 5,7-dimethyl-3-[(2-phenylethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidine |
| Molecular Weight: | 284.38 |
| Molecular Formula: | C15 H16 N4 S |
| Smiles: | Cc1cc(C)n2c(nnc2n1)SCCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7797 |
| logD: | 2.7797 |
| logSw: | -2.7585 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.653 |
| InChI Key: | FIRWRVLVHCIZTJ-UHFFFAOYSA-N |