2-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-(2-methyl-6-nitrophenyl)acetamide
Chemical Structure Depiction of
2-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-(2-methyl-6-nitrophenyl)acetamide
2-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-(2-methyl-6-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | 8018-1157 |
| Compound Name: | 2-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-(2-methyl-6-nitrophenyl)acetamide |
| Molecular Weight: | 372.4 |
| Molecular Formula: | C16 H16 N6 O3 S |
| Smiles: | Cc1cccc(c1NC(CSc1nc2nc(C)cc(C)n2n1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7835 |
| logD: | 1.7626 |
| logSw: | -2.5656 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.114 |
| InChI Key: | LLFOTFJDRDVNEQ-UHFFFAOYSA-N |