methyl S-benzyl-N-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}cysteinate
Chemical Structure Depiction of
methyl S-benzyl-N-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}cysteinate
methyl S-benzyl-N-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}cysteinate
Compound characteristics
| Compound ID: | 8018-7874 |
| Compound Name: | methyl S-benzyl-N-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}cysteinate |
| Molecular Weight: | 405.54 |
| Molecular Formula: | C19 H23 N3 O3 S2 |
| Smiles: | Cc1cc(C)nc(n1)SCC(NC(CSCc1ccccc1)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4956 |
| logD: | 2.4956 |
| logSw: | -2.8047 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.149 |
| InChI Key: | XNIYNEHVYIAWEJ-INIZCTEOSA-N |