N-(4-acetamidophenyl)-5-chloro-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-5-chloro-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
N-(4-acetamidophenyl)-5-chloro-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D244-0127 |
| Compound Name: | N-(4-acetamidophenyl)-5-chloro-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide |
| Molecular Weight: | 426.92 |
| Molecular Formula: | C21 H19 Cl N4 O2 S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1cccc(C)c1)[Cl])=O)c1ccc(cc1)NC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6694 |
| logD: | 4.668 |
| logSw: | -4.7749 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.905 |
| InChI Key: | OXVQLLAAFSLWOF-UHFFFAOYSA-N |