propan-2-yl (2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)acetate
Chemical Structure Depiction of
propan-2-yl (2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)acetate
propan-2-yl (2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)acetate
Compound characteristics
| Compound ID: | D347-0205 |
| Compound Name: | propan-2-yl (2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)acetate |
| Molecular Weight: | 404.91 |
| Molecular Formula: | C20 H21 Cl N2 O3 S |
| Smiles: | CC(C)OC(Cn1c2ccccc2nc1SCCOc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8195 |
| logD: | 4.8155 |
| logSw: | -4.7775 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.091 |
| InChI Key: | KLGLSYSIRMUJTL-UHFFFAOYSA-N |