2-{[1-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{[1-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
2-{[1-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | F711-0730 |
| Compound Name: | 2-{[1-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}-N-(3-fluorophenyl)acetamide |
| Molecular Weight: | 462.93 |
| Molecular Formula: | C21 H20 Cl F N4 O3 S |
| Smiles: | C(c1ccc(cc1)[Cl])NC(Cn1c(CO)cnc1SCC(Nc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9451 |
| logD: | 2.9448 |
| logSw: | -3.3046 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.98 |
| InChI Key: | DKOWBFUVRIRXJP-UHFFFAOYSA-N |