2-(4-chlorophenyl)-N-{2-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}acetamide
Chemical Structure Depiction of
2-(4-chlorophenyl)-N-{2-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}acetamide
2-(4-chlorophenyl)-N-{2-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}acetamide
Compound characteristics
| Compound ID: | C301-9011 |
| Compound Name: | 2-(4-chlorophenyl)-N-{2-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}acetamide |
| Molecular Weight: | 423.92 |
| Molecular Formula: | C21 H18 Cl N5 O S |
| Smiles: | Cc1c(C)nc2ncnn2c1Sc1ccccc1NC(Cc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9882 |
| logD: | 3.9881 |
| logSw: | -4.4182 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.476 |
| InChI Key: | MWTVOATZRKMRDR-UHFFFAOYSA-N |