2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
Chemical Structure Depiction of
2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
Compound characteristics
| Compound ID: | 8016-7956 |
| Compound Name: | 2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide |
| Molecular Weight: | 400.38 |
| Molecular Formula: | C16 H15 F3 N4 O3 S |
| Smiles: | C=CCN1C(=CC(N=C1SCC(Nc1ccc(cc1)OC(F)(F)F)=O)=O)N |
| Stereo: | ACHIRAL |
| logP: | 2.5467 |
| logD: | 2.5467 |
| logSw: | -2.8793 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.149 |
| InChI Key: | SJDDNGBUBRCMDE-UHFFFAOYSA-N |