N-[(3,4-dimethoxyphenyl)methyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
N-[(3,4-dimethoxyphenyl)methyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0211 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 333.41 |
| Molecular Formula: | C16 H19 N3 O3 S |
| Smiles: | Cc1c(cnc(n1)SC)C(NCc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2038 |
| logD: | 2.2038 |
| logSw: | -2.8313 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.304 |
| InChI Key: | CIOVQUXYYDUHHC-UHFFFAOYSA-N |