AC1MXG9J
4-[(4-chlorophenyl)methylsulfanylmethyl]-6-(4-fluorophenyl)sulfanyl-2-phenylpyrimidine
Also Known As: KS-000039MW|5L-546S|4-(((4-Chlorobenzyl)sulfanyl)methyl)-6-((4-fluorophenyl)sulfanyl)-2-phenylpyrimidine|4-[(4-chlorophenyl)methylsulfanylmethyl]-6-(4-fluorophenyl)sulfanyl-2-phenylpyrimidine|4-({[(4-chlorophenyl)methyl]sulfanyl}methyl)-6-[(4-fluorophenyl)sulfanyl]-2-phenylpyrimidine|4-[(4-chlorophenyl)methylsulfanylmethyl]-6-(4-fluorophenyl)sulfanyl-2-phenyl-pyrimidine|4-chlorobenzyl {6-[(4-fluorophenyl)sulfanyl]-2-phenyl-4-pyrimidinyl}methyl sulfide
| Molecular Formula | C24H18ClFN2S2 |
|---|---|
| Molecular Weight | 452.0584 g/mol |
| LogP | 7.5207 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.0584 |
| Monoisotopic Mass | 452.0584 |
| Heavy Atoms | 30 |
| Complexity | 1104.3566 |
Chemical Identifiers
| CAS Number | 338960-99-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=CC(=N2)SC3=CC=C(C=C3)F)CSCC4=CC=C(C=C4)Cl |
Product Overview
AC1MXG9J (CAS 338960-99-9), with molecular formula C24H18ClFN2S2 and molecular weight 452.0584 g/mol. IUPAC: 4-[(4-chlorophenyl)methylsulfanylmethyl]-6-(4-fluorophenyl)sulfanyl-2-phenylpyrimidine.
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