2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2,5-difluorophenyl)acetamide
Chemical Structure Depiction of
2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2,5-difluorophenyl)acetamide
2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2,5-difluorophenyl)acetamide
Compound characteristics
| Compound ID: | E682-0100 |
| Compound Name: | 2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2,5-difluorophenyl)acetamide |
| Molecular Weight: | 464.51 |
| Molecular Formula: | C20 H18 F2 N4 O3 S2 |
| Smiles: | Cc1ccc(cc1C)S(c1cnc(nc1N)SCC(Nc1cc(ccc1F)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7595 |
| logD: | 3.7501 |
| logSw: | -3.9213 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.431 |
| InChI Key: | JEHQNIBEGNFGAB-UHFFFAOYSA-N |