2-{[(3-iodophenyl)methyl]sulfanyl}-5-methoxy-1H-benzimidazole
Chemical Structure Depiction of
2-{[(3-iodophenyl)methyl]sulfanyl}-5-methoxy-1H-benzimidazole
2-{[(3-iodophenyl)methyl]sulfanyl}-5-methoxy-1H-benzimidazole
Compound characteristics
| Compound ID: | 3736-0402 |
| Compound Name: | 2-{[(3-iodophenyl)methyl]sulfanyl}-5-methoxy-1H-benzimidazole |
| Molecular Weight: | 396.25 |
| Molecular Formula: | C15 H13 I N2 O S |
| Smiles: | COc1ccc2c(c1)nc([nH]2)SCc1cccc(c1)I |
| Stereo: | ACHIRAL |
| logP: | 4.415 |
| logD: | 4.3982 |
| logSw: | -4.4204 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.5237 |
| InChI Key: | KUBKECQMEISWOA-UHFFFAOYSA-N |