N-(butan-2-yl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(butan-2-yl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
N-(butan-2-yl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0359 |
| Compound Name: | N-(butan-2-yl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide |
| Molecular Weight: | 301.41 |
| Molecular Formula: | C16 H19 N3 O S |
| Smiles: | CCC(C)NC(c1cnc(nc1c1ccccc1)SC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1525 |
| logD: | 3.1525 |
| logSw: | -3.3866 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.679 |
| InChI Key: | SIHQYKFLJLICOM-NSHDSACASA-N |