N-(4-chloro-2-methylphenyl)-2-[(4-{[(4-methylphenyl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-chloro-2-methylphenyl)-2-[(4-{[(4-methylphenyl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
N-(4-chloro-2-methylphenyl)-2-[(4-{[(4-methylphenyl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 3536-0108 |
| Compound Name: | N-(4-chloro-2-methylphenyl)-2-[(4-{[(4-methylphenyl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 445.99 |
| Molecular Formula: | C21 H20 Cl N3 O2 S2 |
| Smiles: | Cc1ccc(cc1)SCC1=CC(NC(=N1)SCC(Nc1ccc(cc1C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6934 |
| logD: | 3.7447 |
| logSw: | -4.7211 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.087 |
| InChI Key: | QLHSUQLXGUBIDT-UHFFFAOYSA-N |