2-({5,7-dimethyl-6-[(2-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-({5,7-dimethyl-6-[(2-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(thiophen-2-yl)methyl]acetamide
2-({5,7-dimethyl-6-[(2-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C179-0027 |
| Compound Name: | 2-({5,7-dimethyl-6-[(2-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(thiophen-2-yl)methyl]acetamide |
| Molecular Weight: | 437.58 |
| Molecular Formula: | C22 H23 N5 O S2 |
| Smiles: | Cc1ccccc1Cc1c(C)nc2nc(nn2c1C)SCC(NCc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4352 |
| logD: | 4.4351 |
| logSw: | -4.3492 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.045 |
| InChI Key: | NASRHIZJFVHENJ-UHFFFAOYSA-N |