N-[2-(2,5-dimethoxyphenyl)ethyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[2-(2,5-dimethoxyphenyl)ethyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
N-[2-(2,5-dimethoxyphenyl)ethyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0229 |
| Compound Name: | N-[2-(2,5-dimethoxyphenyl)ethyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 347.43 |
| Molecular Formula: | C17 H21 N3 O3 S |
| Smiles: | Cc1c(cnc(n1)SC)C(NCCc1cc(ccc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8719 |
| logD: | 2.8719 |
| logSw: | -3.3951 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.059 |
| InChI Key: | CTLRFEPWUHJBOT-UHFFFAOYSA-N |