2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-6-methylpyrimidin-4(3H)-one
2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4657-0435 |
| Compound Name: | 2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 292.35 |
| Molecular Formula: | C14 H16 N2 O3 S |
| Smiles: | CC1=CC(NC(=N1)SCCOc1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0859 |
| logD: | -0.1633 |
| logSw: | -2.9289 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.262 |
| InChI Key: | JUIWAMHSSJAZMN-UHFFFAOYSA-N |