2-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-(3-methoxyphenyl)pyrimidin-4-ol
Chemical Structure Depiction of
2-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-(3-methoxyphenyl)pyrimidin-4-ol
2-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-(3-methoxyphenyl)pyrimidin-4-ol
Compound characteristics
| Compound ID: | G807-0574 |
| Compound Name: | 2-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-(3-methoxyphenyl)pyrimidin-4-ol |
| Molecular Weight: | 436.44 |
| Molecular Formula: | C21 H16 N4 O5 S |
| Smiles: | COc1cccc(c1)c1cc(nc(n1)SCc1nc(c2ccc3c(c2)OCO3)no1)O |
| Stereo: | ACHIRAL |
| logP: | 4.9934 |
| logD: | 4.7565 |
| logSw: | -4.5662 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.25 |
| InChI Key: | ZTPNOBOCDUFKPV-UHFFFAOYSA-N |