N-benzyl-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-benzyl-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
N-benzyl-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-1317 |
| Compound Name: | N-benzyl-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide |
| Molecular Weight: | 301.41 |
| Molecular Formula: | C16 H19 N3 O S |
| Smiles: | CCCc1c(cnc(n1)SC)C(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5391 |
| logD: | 3.5388 |
| logSw: | -3.6087 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.732 |
| InChI Key: | VGFZSZPYEXVHCI-UHFFFAOYSA-N |