AC1LW8UU
2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile
Also Known As: AK-777/36935035|2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile|2-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl]sulfanyl}-4-(4-fluorophenyl)-6-phenylnicotinonitrile|2-((2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl)thio)-4-(4-fluorophenyl)-6-phenylnicotinonitrile|2-[2-(3,5-dimethylpyrazolyl)-2-oxoethylthio]-4-(4-fluorophenyl)-6-phenylpyridi ne-3-carbonitrile|2-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl]sulfanyl}-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile
| Molecular Formula | C25H19FN4OS |
|---|---|
| Molecular Weight | 442.12637 g/mol |
| LogP | 5.67222 |
| Topological Polar Surface Area | 71.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.12637 |
| Monoisotopic Mass | 442.12637 |
| Heavy Atoms | 32 |
| Complexity | 1324.8068 |
Chemical Identifiers
| CAS Number | 311809-98-0 |
|---|---|
| SMILES | CC1=CC(=NN1C(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)F)C#N)C |
Product Overview
AC1LW8UU (CAS 311809-98-0), with molecular formula C25H19FN4OS and molecular weight 442.12637 g/mol. IUPAC: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile.
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