N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methoxybenzamide
Chemical Structure Depiction of
N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methoxybenzamide
N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methoxybenzamide
Compound characteristics
| Compound ID: | L281-0083 |
| Compound Name: | N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methoxybenzamide |
| Molecular Weight: | 405.48 |
| Molecular Formula: | C21 H19 N5 O2 S |
| Smiles: | Cc1c(C)nc2ncnn2c1Sc1ccc(cc1)NC(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8469 |
| logD: | 3.8468 |
| logSw: | -4.1555 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.931 |
| InChI Key: | BIUIJYFSGVCYBT-UHFFFAOYSA-N |