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Home > Fluorides > 303162-55-2
303162-55-2 | Pyridine, 2-fluoro-4-[4-(3-methylphenyl)-2-[4-(methylthio)phenyl]-5-thiazolyl]-
CAS No: 303162-55-2 Catalog No: AG002ZP7 MDL No:
Product Description
Catalog Number:
AG002ZP7
Chemical Name:
Pyridine, 2-fluoro-4-[4-(3-methylphenyl)-2-[4-(methylthio)phenyl]-5-thiazolyl]-
CAS Number:
303162-55-2
Molecular Formula:
C22H17FN2S2
Molecular Weight:
392.5122
IUPAC Name:
5-(2-fluoropyridin-4-yl)-4-(3-methylphenyl)-2-(4-methylsulfanylphenyl)-1,3-thiazole
InChI:
InChI=1S/C22H17FN2S2/c1-14-4-3-5-16(12-14)20-21(17-10-11-24-19(23)13-17)27-22(25-20)15-6-8-18(26-2)9-7-15/h3-13H,1-2H3
InChI Key:
CPTCWHKUYHDMIZ-UHFFFAOYSA-N
SMILES:
CSc1ccc(cc1)c1sc(c(n1)c1cccc(c1)C)c1ccnc(c1)F
Properties
Complexity:
471
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.082g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
392.51g/mol
Monoisotopic Mass:
392.082g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
79.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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