N-[2-(3,4-diethoxyphenyl)ethyl]-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
N-[2-(3,4-diethoxyphenyl)ethyl]-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-1131 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 389.52 |
| Molecular Formula: | C20 H27 N3 O3 S |
| Smiles: | CCc1c(cnc(n1)SC)C(NCCc1ccc(c(c1)OCC)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9571 |
| logD: | 2.9571 |
| logSw: | -3.3598 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.994 |
| InChI Key: | JMKFXLUJIFNVAJ-UHFFFAOYSA-N |