ethyl 1-(3-ethoxypropyl)-2-{[(3-iodophenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 1-(3-ethoxypropyl)-2-{[(3-iodophenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate
ethyl 1-(3-ethoxypropyl)-2-{[(3-iodophenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V005-7050 |
| Compound Name: | ethyl 1-(3-ethoxypropyl)-2-{[(3-iodophenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 524.42 |
| Molecular Formula: | C22 H25 I N2 O3 S |
| Salt: | not_available |
| Smiles: | CCOCCCn1c2ccc(cc2nc1SCc1cccc(c1)I)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 6.2447 |
| logD: | 6.2434 |
| logSw: | -5.415 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.458 |
| InChI Key: | PZHUTBQITJZZAT-UHFFFAOYSA-N |