N-[2-(3,4-diethoxyphenyl)ethyl]-2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetamide
N-[2-(3,4-diethoxyphenyl)ethyl]-2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetamide
Compound characteristics
| Compound ID: | 8013-2179 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C22 H27 N5 O3 S |
| Smiles: | CCOc1ccc(CCNC(Cn2nc(c3ccc(cc3)SC)nn2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.879 |
| logD: | 2.879 |
| logSw: | -3.3952 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.075 |
| InChI Key: | QXCYAFMSOWHQTO-UHFFFAOYSA-N |