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1248104-45-1 | 4-Pyrimidinamine, 2-(1,3,5-trimethyl-1H-pyrazol-4-yl)-
CAS No: 1248104-45-1 Catalog No: AG000MRB MDL No:MFCD16690946
Product Description
Catalog Number:
AG000MRB
Chemical Name:
4-Pyrimidinamine, 2-(1,3,5-trimethyl-1H-pyrazol-4-yl)-
CAS Number:
1248104-45-1
Molecular Formula:
C10H13N5
Molecular Weight:
203.2437
MDL Number:
MFCD16690946
IUPAC Name:
2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine
InChI:
InChI=1S/C10H13N5/c1-6-9(7(2)15(3)14-6)10-12-5-4-8(11)13-10/h4-5H,1-3H3,(H2,11,12,13)
InChI Key:
WUVOZRQKGBIVTO-UHFFFAOYSA-N
SMILES:
Nc1ccnc(n1)c1c(C)nn(c1C)C
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.117g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.249g/mol
Monoisotopic Mass:
203.117g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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