2-{[1-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-{[1-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
2-{[1-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | F711-0677 |
| Compound Name: | 2-{[1-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 496.48 |
| Molecular Formula: | C22 H20 F4 N4 O3 S |
| Smiles: | C(c1ccc(cc1)F)NC(Cn1c(CO)cnc1SCC(Nc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2693 |
| logD: | 3.2687 |
| logSw: | -3.238 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.98 |
| InChI Key: | LAXRQTIGHKXOBY-UHFFFAOYSA-N |