Cas no 59807-21-5 (Pyrimidine, 2-(methylthio)-4,6-diphenyl-)
59807-21-5 structure
Product Name:Pyrimidine, 2-(methylthio)-4,6-diphenyl-
CAS No:59807-21-5
MF:C17H14N2S
MW:278.371462345123
CID:2834427
PubChem ID:10989556
Update Time:2025-04-21
Pyrimidine, 2-(methylthio)-4,6-diphenyl- Chemical and Physical Properties
Names and Identifiers
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- DTXSID00451018
- SCHEMBL13133556
- DTXCID20401838
- 59807-21-5
- Pyrimidine, 2-(methylthio)-4,6-diphenyl-
-
- Inchi： 1S/C17H14N2S/c1-20-17-18-15(13-8-4-2-5-9-13)12-16(19-17)14-10-6-3-7-11-14/h2-12H,1H3
- InChI Key： PCQRJYVGHCCHOJ-UHFFFAOYSA-N
- SMILES： S(C)C1=NC(=CC(C2C=CC=CC=2)=N1)C1C=CC=CC=1
Computed Properties
- Exact Mass: 278.08776963Da
- Monoisotopic Mass: 278.08776963Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- Complexity: 259
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.4
- Topological Polar Surface Area: 51.1?2
Pyrimidine, 2-(methylthio)-4,6-diphenyl- Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
59807-21-5 (Pyrimidine, 2-(methylthio)-4,6-diphenyl-) Related Products
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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