2-({5-[(4-chlorophenyl)methyl]-4-hydroxy-6-methylpyrimidin-2-yl}sulfanyl)-N-(4-nitrophenyl)acetamide
Chemical Structure Depiction of
2-({5-[(4-chlorophenyl)methyl]-4-hydroxy-6-methylpyrimidin-2-yl}sulfanyl)-N-(4-nitrophenyl)acetamide
2-({5-[(4-chlorophenyl)methyl]-4-hydroxy-6-methylpyrimidin-2-yl}sulfanyl)-N-(4-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | Y512-4887 |
| Compound Name: | 2-({5-[(4-chlorophenyl)methyl]-4-hydroxy-6-methylpyrimidin-2-yl}sulfanyl)-N-(4-nitrophenyl)acetamide |
| Molecular Weight: | 444.89 |
| Molecular Formula: | C20 H17 Cl N4 O4 S |
| Smiles: | Cc1c(Cc2ccc(cc2)[Cl])c(nc(n1)SCC(Nc1ccc(cc1)[N+]([O-])=O)=O)O |
| Stereo: | ACHIRAL |
| logP: | 4.386 |
| logD: | 4.366 |
| logSw: | -4.496 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.06 |
| InChI Key: | IFYIYWRBYIWAMI-UHFFFAOYSA-N |