N-(2-benzoylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(2-benzoylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
N-(2-benzoylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-1298 |
| Compound Name: | N-(2-benzoylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C22 H21 N3 O2 S |
| Smiles: | CCCc1c(cnc(n1)SC)C(Nc1ccccc1C(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6398 |
| logD: | 4.6079 |
| logSw: | -4.3652 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.18 |
| InChI Key: | NGZLJFOPQCEWSG-UHFFFAOYSA-N |