Home Other Building Blocks 1-{[1,2,4]triazolo[4,3-b]pyridazin-6-yl}pyrrolidin-3-amine

1-{[1,2,4]triazolo[4,3-b]pyridazin-6-yl}pyrrolidin-3-amine

CAS No.:
1523644-76-9
Catalog Number:
AG01B77E
Molecular Formula:
C9H12N6
Molecular Weight:
204.2318
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Product Description
Catalog Number:
AG01B77E
Chemical Name:
1-{[1,2,4]triazolo[4,3-b]pyridazin-6-yl}pyrrolidin-3-amine
CAS Number:
1523644-76-9
Molecular Formula:
C9H12N6
Molecular Weight:
204.2318
MDL Number:
MFCD18916146
IUPAC Name:
1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrrolidin-3-amine
InChI:
InChI=1S/C9H12N6/c10-7-3-4-14(5-7)9-2-1-8-12-11-6-15(8)13-9/h1-2,6-7H,3-5,10H2
InChI Key:
LMSHGIGSQOUROF-UHFFFAOYSA-N
SMILES:
NC1CCN(C1)c1ccc2n(n1)cnn2
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.112g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.237g/mol
Monoisotopic Mass:
204.112g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties