Home Other Building Blocks 4-(isoquinolin-1-yl)-1,3-thiazol-2-amine

4-(isoquinolin-1-yl)-1,3-thiazol-2-amine

CAS No.:
651042-73-8
Catalog Number:
AG01BB5X
Molecular Formula:
C12H9N3S
Molecular Weight:
227.2850
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Product Description
Catalog Number:
AG01BB5X
Chemical Name:
4-(isoquinolin-1-yl)-1,3-thiazol-2-amine
CAS Number:
651042-73-8
Molecular Formula:
C12H9N3S
Molecular Weight:
227.2850
MDL Number:
MFCD26036866
IUPAC Name:
4-isoquinolin-1-yl-1,3-thiazol-2-amine
InChI:
InChI=1S/C12H9N3S/c13-12-15-10(7-16-12)11-9-4-2-1-3-8(9)5-6-14-11/h1-7H,(H2,13,15)
InChI Key:
YLNUDNTUPQXQBM-UHFFFAOYSA-N
SMILES:
Nc1scc(n1)c1nccc2c1cccc2
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.052g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.285g/mol
Monoisotopic Mass:
227.052g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties