2-[(5-butyl-4-methyl-1H-imidazol-2-yl)sulfanyl]-N-{3-cyano-4-methyl-5-[2-(methylsulfanyl)ethyl]-1H-pyrrol-2-yl}acetamide
Chemical Structure Depiction of
2-[(5-butyl-4-methyl-1H-imidazol-2-yl)sulfanyl]-N-{3-cyano-4-methyl-5-[2-(methylsulfanyl)ethyl]-1H-pyrrol-2-yl}acetamide
2-[(5-butyl-4-methyl-1H-imidazol-2-yl)sulfanyl]-N-{3-cyano-4-methyl-5-[2-(methylsulfanyl)ethyl]-1H-pyrrol-2-yl}acetamide
Compound characteristics
| Compound ID: | 8019-5480 |
| Compound Name: | 2-[(5-butyl-4-methyl-1H-imidazol-2-yl)sulfanyl]-N-{3-cyano-4-methyl-5-[2-(methylsulfanyl)ethyl]-1H-pyrrol-2-yl}acetamide |
| Molecular Weight: | 405.58 |
| Molecular Formula: | C19 H27 N5 O S2 |
| Smiles: | CCCCc1c(C)nc([nH]1)SCC(Nc1c(C#N)c(C)c(CCSC)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0191 |
| logD: | 2.7257 |
| logSw: | -3.1135 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.866 |
| InChI Key: | KOZALAFWSZTTLR-UHFFFAOYSA-N |