N-[2-(3,4-diethoxyphenyl)ethyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
N-[2-(3,4-diethoxyphenyl)ethyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0163 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 375.49 |
| Molecular Formula: | C19 H25 N3 O3 S |
| Smiles: | CCOc1ccc(CCNC(c2cnc(nc2C)SC)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.5307 |
| logD: | 2.5307 |
| logSw: | -2.9058 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.306 |
| InChI Key: | ZNBCUJCUKBSZJC-UHFFFAOYSA-N |