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863305-81-1 | 4-(3-Chlorothiophen-2-yl);-6-methylpyrimidin-2-amine
CAS No: 863305-81-1 Catalog No: AG004IUY MDL No:MFCD03791190
Product Description
Catalog Number:
AG004IUY
Chemical Name:
4-(3-Chlorothiophen-2-yl);-6-methylpyrimidin-2-amine
CAS Number:
863305-81-1
Molecular Formula:
C9H8ClN3S
Molecular Weight:
225.6979
MDL Number:
MFCD03791190
IUPAC Name:
4-(3-chlorothiophen-2-yl)-6-methylpyrimidin-2-amine
InChI:
InChI=1S/C9H8ClN3S/c1-5-4-7(13-9(11)12-5)8-6(10)2-3-14-8/h2-4H,1H3,(H2,11,12,13)
InChI Key:
NCCNGSGPPIHEMZ-UHFFFAOYSA-N
SMILES:
Cc1nc(N)nc(c1)c1sccc1Cl
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.013g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.694g/mol
Monoisotopic Mass:
225.013g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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