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113638-78-1

113638-78-1 | 1,3-Propanediamine, N1-(3,8-dimethyl-3H-imidazo[4,5-f]quinoxalin-2-yl)-

CAS No: 113638-78-1 Catalog No: AG00097U MDL No:

Product Description

Catalog Number:
AG00097U
Chemical Name:
1,3-Propanediamine, N1-(3,8-dimethyl-3H-imidazo[4,5-f]quinoxalin-2-yl)-
CAS Number:
113638-78-1
Molecular Formula:
C14H18N6
Molecular Weight:
270.3329
IUPAC Name:
N'-(3,8-dimethylimidazo[4,5-f]quinoxalin-2-yl)propane-1,3-diamine
InChI:
InChI=1S/C14H18N6/c1-9-8-17-10-4-5-11-13(12(10)18-9)19-14(20(11)2)16-7-3-6-15/h4-5,8H,3,6-7,15H2,1-2H3,(H,16,19)
InChI Key:
CJIKVUVZLGXTNB-UHFFFAOYSA-N
SMILES:
NCCCNc1nc2c(n1C)ccc1c2nc(C)cn1

Properties

Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.159g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
270.34g/mol
Monoisotopic Mass:
270.159g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
81.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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