N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}butanamide
Chemical Structure Depiction of
N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}butanamide
N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}butanamide
Compound characteristics
| Compound ID: | L281-0103 |
| Compound Name: | N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}butanamide |
| Molecular Weight: | 341.43 |
| Molecular Formula: | C17 H19 N5 O S |
| Smiles: | CCCC(Nc1ccc(cc1)Sc1c(C)c(C)nc2ncnn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2198 |
| logD: | 3.2197 |
| logSw: | -3.3735 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.445 |
| InChI Key: | HOLGCAVVDUJZCJ-UHFFFAOYSA-N |