N-(2H-1,3-benzodioxol-5-yl)-2-{[4-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{[4-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{[4-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | L966-0050 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{[4-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 478.55 |
| Molecular Formula: | C23 H18 N4 O4 S2 |
| Smiles: | Cc1c(C2=CC(NC(=N2)SCC(Nc2ccc3c(c2)OCO3)=O)=O)sc(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.953 |
| logD: | 3.6331 |
| logSw: | -4.0016 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.105 |
| InChI Key: | MTMWKORJCNTXPC-UHFFFAOYSA-N |