2-{[7-(4-methoxyphenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]sulfanyl}-1-phenylethan-1-one
Chemical Structure Depiction of
2-{[7-(4-methoxyphenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]sulfanyl}-1-phenylethan-1-one
2-{[7-(4-methoxyphenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]sulfanyl}-1-phenylethan-1-one
Compound characteristics
| Compound ID: | C202-1963 |
| Compound Name: | 2-{[7-(4-methoxyphenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]sulfanyl}-1-phenylethan-1-one |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | COc1ccc(cc1)C1CC(=Nc2ncnn12)SCC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3003 |
| logD: | 3.2972 |
| logSw: | -3.503 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.201 |
| InChI Key: | UFQJRGWOFZGTCQ-QGZVFWFLSA-N |