N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[1-(4-iodophenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[1-(4-iodophenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[1-(4-iodophenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8014-2700 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[1-(4-iodophenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 525.37 |
| Molecular Formula: | C19 H20 I N5 O3 S |
| Smiles: | COc1ccc(CCNC(CSc2nnnn2c2ccc(cc2)I)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.0789 |
| logD: | 3.0789 |
| logSw: | -3.4125 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.463 |
| InChI Key: | YUUITGWLVHWPTG-UHFFFAOYSA-N |