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246020-85-9 | 3-Pyridinecarbonitrile, 2-chloro-6-methyl-5-(2-methyl-4-thiazolyl)-
CAS No: 246020-85-9 Catalog No: AG002OQA MDL No:
Product Description
Catalog Number:
AG002OQA
Chemical Name:
3-Pyridinecarbonitrile, 2-chloro-6-methyl-5-(2-methyl-4-thiazolyl)-
CAS Number:
246020-85-9
Molecular Formula:
C11H8ClN3S
Molecular Weight:
249.7193
IUPAC Name:
2-chloro-6-methyl-5-(2-methyl-1,3-thiazol-4-yl)pyridine-3-carbonitrile
InChI:
InChI=1S/C11H8ClN3S/c1-6-9(10-5-16-7(2)15-10)3-8(4-13)11(12)14-6/h3,5H,1-2H3
InChI Key:
WTHYDGPBYTXJCS-UHFFFAOYSA-N
SMILES:
N#Cc1cc(c2csc(n2)C)c(nc1Cl)C
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.013g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.716g/mol
Monoisotopic Mass:
249.013g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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