2-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl ({1-[(4-fluorophenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
2-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl ({1-[(4-fluorophenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
2-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl ({1-[(4-fluorophenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | D425-2388 |
| Compound Name: | 2-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl ({1-[(4-fluorophenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate |
| Molecular Weight: | 485.56 |
| Molecular Formula: | C22 H20 F N5 O3 S2 |
| Smiles: | CCc1nnc(NC(COC(CSc2nc3ccccc3n2Cc2ccc(cc2)F)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.7475 |
| logD: | 4.6681 |
| logSw: | -4.4285 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.201 |
| InChI Key: | RGSZQPCVZGCITL-UHFFFAOYSA-N |