methyl N-{[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]acetyl}phenylalaninate
Chemical Structure Depiction of
methyl N-{[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]acetyl}phenylalaninate
methyl N-{[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]acetyl}phenylalaninate
Compound characteristics
| Compound ID: | 8019-5490 |
| Compound Name: | methyl N-{[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]acetyl}phenylalaninate |
| Molecular Weight: | 347.43 |
| Molecular Formula: | C17 H21 N3 O3 S |
| Smiles: | Cc1c(C)[nH]c(n1)SCC(NC(Cc1ccccc1)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.698 |
| logD: | 1.2797 |
| logSw: | -2.2383 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.708 |
| InChI Key: | NBVMEESULGQAID-AWEZNQCLSA-N |