2-{[5-(4-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{[5-(4-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
2-{[5-(4-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | G605-0628 |
| Compound Name: | 2-{[5-(4-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide |
| Molecular Weight: | 475.56 |
| Molecular Formula: | C22 H22 F N3 O4 S2 |
| Smiles: | CCCCc1ccc(cc1)S(C1=CN=C(NC1=O)SCC(Nc1ccccc1F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7678 |
| logD: | 2.1261 |
| logSw: | -3.8191 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.442 |
| InChI Key: | CUFRBSMJYAEXPK-UHFFFAOYSA-N |