4-methyl-N-[(3-methylphenyl)methyl]-2-(methylsulfanyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-methyl-N-[(3-methylphenyl)methyl]-2-(methylsulfanyl)pyrimidine-5-carboxamide
4-methyl-N-[(3-methylphenyl)methyl]-2-(methylsulfanyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0089 |
| Compound Name: | 4-methyl-N-[(3-methylphenyl)methyl]-2-(methylsulfanyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 287.38 |
| Molecular Formula: | C15 H17 N3 O S |
| Smiles: | Cc1cccc(CNC(c2cnc(nc2C)SC)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.2774 |
| logD: | 3.2771 |
| logSw: | -3.4736 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.043 |
| InChI Key: | VRCFLDAUVCVUQG-UHFFFAOYSA-N |