N-(5-chloro-2,4-dimethoxyphenyl)-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0039 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 353.83 |
| Molecular Formula: | C15 H16 Cl N3 O3 S |
| Smiles: | Cc1c(cnc(n1)SC)C(Nc1cc(c(cc1OC)OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1222 |
| logD: | 2.1346 |
| logSw: | -3.4501 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.284 |
| InChI Key: | PYRDCDLJIGIFII-UHFFFAOYSA-N |