2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(4-methoxyphenyl)propanamide
Chemical Structure Depiction of
2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(4-methoxyphenyl)propanamide
2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(4-methoxyphenyl)propanamide
Compound characteristics
| Compound ID: | D285-0151 |
| Compound Name: | 2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(4-methoxyphenyl)propanamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C21 H18 N4 O3 S |
| Smiles: | CC(C(Nc1ccc(cc1)OC)=O)SC1NC(C(C#N)=C(c2ccccc2)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2559 |
| logD: | 0.1499 |
| logSw: | -3.6965 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.345 |
| InChI Key: | IOLGCJXEJYGFRO-ZDUSSCGKSA-N |