2-{[5-(3-chlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-difluorophenyl)acetamide
Chemical Structure Depiction of
2-{[5-(3-chlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-difluorophenyl)acetamide
2-{[5-(3-chlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-difluorophenyl)acetamide
Compound characteristics
Compound ID: | C716-0542 |
Compound Name: | 2-{[5-(3-chlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-difluorophenyl)acetamide |
Molecular Weight: | 471.89 |
Molecular Formula: | C18 H12 Cl F2 N3 O4 S2 |
Smiles: | C(C(Nc1ccc(cc1F)F)=O)SC1NC(C(=CN=1)S(c1cccc(c1)[Cl])(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.393 |
logD: | 0.7513 |
logSw: | -3.3866 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.442 |
InChI Key: | SCNHHXVMKSXNMI-UHFFFAOYSA-N |