2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(2,3-dimethylphenyl)propanamide
Chemical Structure Depiction of
2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(2,3-dimethylphenyl)propanamide
2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(2,3-dimethylphenyl)propanamide
Compound characteristics
| Compound ID: | D285-0148 |
| Compound Name: | 2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(2,3-dimethylphenyl)propanamide |
| Molecular Weight: | 404.49 |
| Molecular Formula: | C22 H20 N4 O2 S |
| Smiles: | CC(C(Nc1cccc(C)c1C)=O)SC1NC(C(C#N)=C(c2ccccc2)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2026 |
| logD: | 1.0966 |
| logSw: | -4.2172 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.103 |
| InChI Key: | JXAKWVJAIKVLEF-HNNXBMFYSA-N |