N-{4-[(5-ethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{4-[(5-ethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methylbenzamide
N-{4-[(5-ethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L281-0409 |
| Compound Name: | N-{4-[(5-ethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methylbenzamide |
| Molecular Weight: | 389.48 |
| Molecular Formula: | C21 H19 N5 O S |
| Smiles: | CCc1cc(n2c(ncn2)n1)Sc1ccc(cc1)NC(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5492 |
| logD: | 4.549 |
| logSw: | -4.2988 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.529 |
| InChI Key: | VGMSHSXEJPHIRI-UHFFFAOYSA-N |