N-[(2-ethoxyphenyl)methyl]-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(2-ethoxyphenyl)methyl]-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
N-[(2-ethoxyphenyl)methyl]-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-1157 |
| Compound Name: | N-[(2-ethoxyphenyl)methyl]-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 331.43 |
| Molecular Formula: | C17 H21 N3 O2 S |
| Smiles: | CCc1c(cnc(n1)SC)C(NCc1ccccc1OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6246 |
| logD: | 3.6243 |
| logSw: | -3.6444 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.943 |
| InChI Key: | LICSBGSCWLTIEO-UHFFFAOYSA-N |