2-({[3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-({[3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-methylpyrimidin-4(3H)-one
2-({[3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 7815-0146 |
| Compound Name: | 2-({[3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 360.39 |
| Molecular Formula: | C16 H16 N4 O4 S |
| Smiles: | CC1=CC(NC(=N1)SCc1nc(c2ccc(cc2OC)OC)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2857 |
| logD: | 1.5949 |
| logSw: | -3.1116 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.817 |
| InChI Key: | QPBCOWNQJVCADR-UHFFFAOYSA-N |