2-[2-(3-chlorophenyl)-5-cyano-6-oxopyrimidin-1(6H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[2-(3-chlorophenyl)-5-cyano-6-oxopyrimidin-1(6H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[2-(3-chlorophenyl)-5-cyano-6-oxopyrimidin-1(6H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | M045-1049 |
| Compound Name: | 2-[2-(3-chlorophenyl)-5-cyano-6-oxopyrimidin-1(6H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 410.88 |
| Molecular Formula: | C20 H15 Cl N4 O2 S |
| Smiles: | CSc1cccc(c1)NC(CN1C(c2cccc(c2)[Cl])=NC=C(C#N)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5053 |
| logD: | 3.5053 |
| logSw: | -3.9343 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.544 |
| InChI Key: | OSXWZZIZJGUGFM-UHFFFAOYSA-N |