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1018473-22-7 | 1H-Pyrazol-5-amine, 1-(6-chloro-4-pyrimidinyl)-3-methyl-
CAS No: 1018473-22-7 Catalog No: AG0005PC MDL No:MFCD19440630
Product Description
Catalog Number:
AG0005PC
Chemical Name:
1H-Pyrazol-5-amine, 1-(6-chloro-4-pyrimidinyl)-3-methyl-
CAS Number:
1018473-22-7
Molecular Formula:
C8H8ClN5
Molecular Weight:
209.6356
MDL Number:
MFCD19440630
IUPAC Name:
2-(6-chloropyrimidin-4-yl)-5-methylpyrazol-3-amine
InChI:
InChI=1S/C8H8ClN5/c1-5-2-7(10)14(13-5)8-3-6(9)11-4-12-8/h2-4H,10H2,1H3
InChI Key:
IMTBRUGOHDBTTL-UHFFFAOYSA-N
SMILES:
Cc1nn(c(c1)N)c1ncnc(c1)Cl
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.047g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.637g/mol
Monoisotopic Mass:
209.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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