Home Other Building Blocks 1,3-bis(1,3-dimethyl-1H-pyrazol-5-yl)urea

1,3-bis(1,3-dimethyl-1H-pyrazol-5-yl)urea

CAS No.:
1208696-98-3
Catalog Number:
AG019X4N
Molecular Formula:
C11H16N6O
Molecular Weight:
248.2843
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Product Description
Catalog Number:
AG019X4N
Chemical Name:
1,3-bis(1,3-dimethyl-1H-pyrazol-5-yl)urea
CAS Number:
1208696-98-3
Molecular Formula:
C11H16N6O
Molecular Weight:
248.2843
MDL Number:
MFCD13195989
IUPAC Name:
1,3-bis(2,5-dimethylpyrazol-3-yl)urea
InChI:
InChI=1S/C11H16N6O/c1-7-5-9(16(3)14-7)12-11(18)13-10-6-8(2)15-17(10)4/h5-6H,1-4H3,(H2,12,13,18)
InChI Key:
YKPQIDOCNCFFFW-UHFFFAOYSA-N
SMILES:
O=C(Nc1cc(nn1C)C)Nc1cc(nn1C)C
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.139g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
248.29g/mol
Monoisotopic Mass:
248.139g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties