2-{[5-(4-tert-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-fluoro-2-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(4-tert-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-fluoro-2-methylphenyl)acetamide
2-{[5-(4-tert-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-fluoro-2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | C716-0904 |
| Compound Name: | 2-{[5-(4-tert-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-fluoro-2-methylphenyl)acetamide |
| Molecular Weight: | 489.59 |
| Molecular Formula: | C23 H24 F N3 O4 S2 |
| Smiles: | Cc1cc(ccc1NC(CSC1NC(C(=CN=1)S(c1ccc(cc1)C(C)(C)C)(=O)=O)=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.8319 |
| logD: | 2.1902 |
| logSw: | -3.9037 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.442 |
| InChI Key: | KTTXNHJEURAEFF-UHFFFAOYSA-N |