Cas no 86212-51-3 (4-Phenyl-6-(pyridin-2-yl)pyrimidine-2(1H)-thione)
86212-51-3 structure
Product Name:4-Phenyl-6-(pyridin-2-yl)pyrimidine-2(1H)-thione
CAS No:86212-51-3
MF:C15H11N3S
MW:265.332941293716
CID:2809166
PubChem ID:13155548
Update Time:2025-04-21
4-Phenyl-6-(pyridin-2-yl)pyrimidine-2(1H)-thione Chemical and Physical Properties
Names and Identifiers
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- DTXSID90522807
- SCHEMBL22357053
- DTXCID40473613
- 86212-51-3
- phenyl-6-(pyridin-2-yl)pyrimidin-2-thiol
- 4-Phenyl-6-(pyridin-2-yl)pyrimidine-2(1H)-thione
-
- Inchi： 1S/C15H11N3S/c19-15-17-13(11-6-2-1-3-7-11)10-14(18-15)12-8-4-5-9-16-12/h1-10H,(H,17,18,19)
- InChI Key： GXVNQIKIKHXIOU-UHFFFAOYSA-N
- SMILES： S=C1N=C(C=C(C2C=CC=CN=2)N1)C1C=CC=CC=1
Computed Properties
- Exact Mass: 265.06736854Da
- Monoisotopic Mass: 265.06736854Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 408
- 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: 2.5
- Topological Polar Surface Area: 69.4?2
4-Phenyl-6-(pyridin-2-yl)pyrimidine-2(1H)-thione Related Literature
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
86212-51-3 (4-Phenyl-6-(pyridin-2-yl)pyrimidine-2(1H)-thione) Related Products
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