methyl (2-{[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)(phenyl)acetate
Chemical Structure Depiction of
methyl (2-{[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)(phenyl)acetate
methyl (2-{[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)(phenyl)acetate
Compound characteristics
| Compound ID: | 8017-6761 |
| Compound Name: | methyl (2-{[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)(phenyl)acetate |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | Cc1cccc(c1)N1C(=CC(N=C1SCC(NC(C(=O)OC)c1ccccc1)=O)=O)N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6558 |
| logD: | 1.6557 |
| logSw: | -2.459 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.199 |
| InChI Key: | PEYPPWYFMBENRD-HXUWFJFHSA-N |