2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | C716-0226 |
| Compound Name: | 2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C20 H18 F N3 O4 S2 |
| Smiles: | Cc1ccc(c(C)c1)S(C1=CN=C(NC1=O)SCC(Nc1ccccc1F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6387 |
| logD: | 0.9969 |
| logSw: | -3.0702 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.442 |
| InChI Key: | KZBLNLNNEBFGCB-UHFFFAOYSA-N |