methyl S-benzyl-N-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}cysteinate
Chemical Structure Depiction of
methyl S-benzyl-N-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}cysteinate
methyl S-benzyl-N-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}cysteinate
Compound characteristics
| Compound ID: | 8016-8961 |
| Compound Name: | methyl S-benzyl-N-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}cysteinate |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C18 H21 N3 O4 S2 |
| Smiles: | CC1=CC(NC(=N1)SCC(NC(CSCc1ccccc1)C(=O)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3089 |
| logD: | 0.5869 |
| logSw: | -2.0905 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.576 |
| InChI Key: | VCVXQMWQPVRLIR-AWEZNQCLSA-N |