2-[(5-benzyl-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-benzyl-4-methyl-1H-imidazol-2-yl)sulfanyl]-N-{3-cyano-4-methyl-5-[2-(methylsulfanyl)ethyl]-1H-pyrrol-2-yl}acetamide
2-[(5-benzyl-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: | 8019-3417 |
| Compound Name: | 2-[(5-benzyl-4-methyl-1H-imidazol-2-yl)sulfanyl]-N-{3-cyano-4-methyl-5-[2-(methylsulfanyl)ethyl]-1H-pyrrol-2-yl}acetamide |
| Molecular Weight: | 439.6 |
| Molecular Formula: | C22 H25 N5 O S2 |
| Smiles: | Cc1c(C#N)c(NC(CSc2nc(C)c(Cc3ccccc3)[nH]2)=O)[nH]c1CCSC |
| Stereo: | ACHIRAL |
| logP: | 3.0761 |
| logD: | 2.8039 |
| logSw: | -3.3617 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.595 |
| InChI Key: | ACCVRNQRKBEVDP-UHFFFAOYSA-N |