2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide
2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | G605-1020 |
| Compound Name: | 2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide |
| Molecular Weight: | 461.53 |
| Molecular Formula: | C21 H20 F N3 O4 S2 |
| Smiles: | CCc1ccc(cc1)S(C1=CN=C(NC1=O)SCC(NCc1ccc(cc1)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6595 |
| logD: | 1.0178 |
| logSw: | -3.1097 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.462 |
| InChI Key: | MWCRJDUTCPDHMD-UHFFFAOYSA-N |