N-(4-fluorophenyl)-2-{[1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-1H-benzimidazol-2-yl]sulfanyl}-N-methylacetamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-{[1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-1H-benzimidazol-2-yl]sulfanyl}-N-methylacetamide
N-(4-fluorophenyl)-2-{[1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-1H-benzimidazol-2-yl]sulfanyl}-N-methylacetamide
Compound characteristics
| Compound ID: | G534-1190 |
| Compound Name: | N-(4-fluorophenyl)-2-{[1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-1H-benzimidazol-2-yl]sulfanyl}-N-methylacetamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C23 H21 F N4 O3 S |
| Smiles: | CN(C(CSc1nc2ccccc2n1CC(NCc1ccco1)=O)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 3.7034 |
| logD: | 3.7021 |
| logSw: | -3.9157 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.811 |
| InChI Key: | XNQYYPYVGQIDEH-UHFFFAOYSA-N |