Home Other Building Blocks 5-N-(4-fluorophenyl)isoquinoline-5,8-diamine

5-N-(4-fluorophenyl)isoquinoline-5,8-diamine

CAS No.:
1153123-20-6
Catalog Number:
AG01AH3M
Molecular Formula:
C15H12FN3
Molecular Weight:
253.2743
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Product Description
Catalog Number:
AG01AH3M
Chemical Name:
5-N-(4-fluorophenyl)isoquinoline-5,8-diamine
CAS Number:
1153123-20-6
Molecular Formula:
C15H12FN3
Molecular Weight:
253.2743
MDL Number:
MFCD12668727
IUPAC Name:
5-N-(4-fluorophenyl)isoquinoline-5,8-diamine
InChI:
InChI=1S/C15H12FN3/c16-10-1-3-11(4-2-10)19-15-6-5-14(17)13-9-18-8-7-12(13)15/h1-9,19H,17H2
InChI Key:
WVTLRMVCVPDQTL-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)Nc1ccc(c2c1ccnc2)N
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.102g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.28g/mol
Monoisotopic Mass:
253.102g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties