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175276-44-5 | 1,3,5-Triazin-2-amine, 4-(2,6-dichloro-4-pyridinyl)-6-(methylthio)-
CAS No: 175276-44-5 Catalog No: AG0020QY MDL No:
Product Description
Catalog Number:
AG0020QY
Chemical Name:
1,3,5-Triazin-2-amine, 4-(2,6-dichloro-4-pyridinyl)-6-(methylthio)-
CAS Number:
175276-44-5
Molecular Formula:
C9H7Cl2N5S
Molecular Weight:
288.1564
IUPAC Name:
4-(2,6-dichloropyridin-4-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine
InChI:
InChI=1S/C9H7Cl2N5S/c1-17-9-15-7(14-8(12)16-9)4-2-5(10)13-6(11)3-4/h2-3H,1H3,(H2,12,14,15,16)
InChI Key:
OMFPHHXAIVPPOD-UHFFFAOYSA-N
SMILES:
CSc1nc(N)nc(n1)c1cc(Cl)nc(c1)Cl
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.98g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.15g/mol
Monoisotopic Mass:
286.98g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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