N-(4-methoxyphenyl)-7-methyl-2-{[(3-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-7-methyl-2-{[(3-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
N-(4-methoxyphenyl)-7-methyl-2-{[(3-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | Y020-2071 |
| Compound Name: | N-(4-methoxyphenyl)-7-methyl-2-{[(3-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C22 H21 N5 O2 S |
| Smiles: | Cc1cccc(CSc2nc3ncc(C(Nc4ccc(cc4)OC)=O)c(C)n3n2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0745 |
| logD: | 4.0742 |
| logSw: | -4.1715 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.406 |
| InChI Key: | ISBJDXPBXQSMLZ-UHFFFAOYSA-N |