Home Other Building Blocks 5-[5-fluoro-1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]-2-methylaniline

5-[5-fluoro-1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]-2-methylaniline

CAS No.:
1183523-85-4
Catalog Number:
AG019RR8
Molecular Formula:
C17H18FN3
Molecular Weight:
283.3433
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Product Description
Catalog Number:
AG019RR8
Chemical Name:
5-[5-fluoro-1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]-2-methylaniline
CAS Number:
1183523-85-4
Molecular Formula:
C17H18FN3
Molecular Weight:
283.3433
MDL Number:
MFCD20441637
IUPAC Name:
5-(5-fluoro-1-propan-2-ylbenzimidazol-2-yl)-2-methylaniline
InChI:
InChI=1S/C17H18FN3/c1-10(2)21-16-7-6-13(18)9-15(16)20-17(21)12-5-4-11(3)14(19)8-12/h4-10H,19H2,1-3H3
InChI Key:
RWPSSNVVTKFPBT-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)nc(n2C(C)C)c1ccc(c(c1)N)C
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.148g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
283.35g/mol
Monoisotopic Mass:
283.148g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties