N-{4-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}butanamide
Chemical Structure Depiction of
N-{4-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}butanamide
N-{4-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}butanamide
Compound characteristics
| Compound ID: | L281-0047 |
| Compound Name: | N-{4-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}butanamide |
| Molecular Weight: | 327.41 |
| Molecular Formula: | C16 H17 N5 O S |
| Smiles: | CCCC(Nc1ccc(cc1)Sc1cc(C)nc2ncnn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8146 |
| logD: | 2.8145 |
| logSw: | -3.2497 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.898 |
| InChI Key: | VVDDRAOKLKGHJX-UHFFFAOYSA-N |