N-benzyl-2-[(5-methyl-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-benzyl-2-[(5-methyl-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
N-benzyl-2-[(5-methyl-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D306-0641 |
| Compound Name: | N-benzyl-2-[(5-methyl-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 389.48 |
| Molecular Formula: | C21 H19 N5 O S |
| Smiles: | Cc1nc(cc2nnc(n12)SCC(NCc1ccccc1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4768 |
| logD: | 2.65 |
| logSw: | -3.8072 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.297 |
| InChI Key: | LGAFHLHVJVQEDI-UHFFFAOYSA-N |