methyl [2-({2-[2-(prop-2-en-1-yl)phenoxy]ethyl}sulfanyl)-1H-benzimidazol-1-yl]acetate
Chemical Structure Depiction of
methyl [2-({2-[2-(prop-2-en-1-yl)phenoxy]ethyl}sulfanyl)-1H-benzimidazol-1-yl]acetate
methyl [2-({2-[2-(prop-2-en-1-yl)phenoxy]ethyl}sulfanyl)-1H-benzimidazol-1-yl]acetate
Compound characteristics
| Compound ID: | D347-0289 |
| Compound Name: | methyl [2-({2-[2-(prop-2-en-1-yl)phenoxy]ethyl}sulfanyl)-1H-benzimidazol-1-yl]acetate |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C21 H22 N2 O3 S |
| Smiles: | COC(Cn1c2ccccc2nc1SCCOc1ccccc1CC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6955 |
| logD: | 4.6915 |
| logSw: | -4.4914 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.832 |
| InChI Key: | MNGJFCYYNUADNI-UHFFFAOYSA-N |