Home Other Building Blocks N-methyl-N'-[1-(propan-2-yl)-1H-pyrazol-5-yl]thiophene-2-carboximidamide

N-methyl-N'-[1-(propan-2-yl)-1H-pyrazol-5-yl]thiophene-2-carboximidamide

CAS No.:
1006482-00-3
Catalog Number:
AG019ONS
Molecular Formula:
C12H16N4S
Molecular Weight:
248.3472
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Product Description
Catalog Number:
AG019ONS
Chemical Name:
N-methyl-N'-[1-(propan-2-yl)-1H-pyrazol-5-yl]thiophene-2-carboximidamide
CAS Number:
1006482-00-3
Molecular Formula:
C12H16N4S
Molecular Weight:
248.3472
MDL Number:
MFCD07346278
IUPAC Name:
N'-methyl-N-(2-propan-2-ylpyrazol-3-yl)thiophene-2-carboximidamide
InChI:
InChI=1S/C12H16N4S/c1-9(2)16-11(6-7-14-16)15-12(13-3)10-5-4-8-17-10/h4-9H,1-3H3,(H,13,15)
InChI Key:
FKJHEJBFOLCDOO-UHFFFAOYSA-N
SMILES:
CNC(=Nc1ccnn1C(C)C)c1cccs1
Properties
Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.11g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.348g/mol
Monoisotopic Mass:
248.11g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties