2-{[5-cyano-4-(4-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide
Chemical Structure Depiction of
2-{[5-cyano-4-(4-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide
2-{[5-cyano-4-(4-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide
Compound characteristics
| Compound ID: | 5025-0070 |
| Compound Name: | 2-{[5-cyano-4-(4-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide |
| Molecular Weight: | 577.64 |
| Molecular Formula: | C26 H23 N7 O5 S2 |
| Smiles: | Cc1cc(C)nc(NS(c2ccc(cc2)NC(CSC2NC(C(C#N)=C(c3ccc(cc3)OC)N=2)=O)=O)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.3253 |
| logD: | -1.2277 |
| logSw: | -2.9958 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 142.099 |
| InChI Key: | YJIMAYZROSDRGK-UHFFFAOYSA-N |