N-(4-methylphenyl)-2-[(5-methyl-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-methylphenyl)-2-[(5-methyl-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
N-(4-methylphenyl)-2-[(5-methyl-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D306-0619 |
| Compound Name: | N-(4-methylphenyl)-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: | Cc1ccc(cc1)NC(CSc1nnc2cc(c3ccccc3)nc(C)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2189 |
| logD: | 3.3921 |
| logSw: | -4.2079 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.975 |
| InChI Key: | ZFBKNWIYDPITBE-UHFFFAOYSA-N |