AC1MDQSI
5-acetyl-4-(2-chlorophenyl)-2-[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl-6-methyl-1,4-dihydropyridine-3-carbonitrile
Also Known As: 5-acetyl-4-(2-chlorophenyl)-2-[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl-6-methyl-1,4-dihydropyridine-3-carbonitrile|5-acetyl-4-(2-chlorophenyl)-2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]thio}-6-methyl-1,4-dihydro-3-pyridinecarbonitrile|5-Acetyl-4-(2-chlorophenyl)-2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-6-methyl-1,4-dihydropyridine-3-carbonitrile
| Molecular Formula | C25H23ClN2O2S |
|---|---|
| Molecular Weight | 450.11688 g/mol |
| LogP | 5.85792 |
| Topological Polar Surface Area | 69.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.11688 |
| Monoisotopic Mass | 450.11688 |
| Heavy Atoms | 31 |
| Complexity | 1174.2848 |
Chemical Identifiers
| CAS Number | 5320-69-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)C)C3=CC=CC=C3Cl)C#N)C |
Product Overview
AC1MDQSI (CAS 5320-69-4), with molecular formula C25H23ClN2O2S and molecular weight 450.11688 g/mol. IUPAC: 5-acetyl-4-(2-chlorophenyl)-2-[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl-6-methyl-1,4-dihydropyridine-3-carbonitrile.
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