NG 52

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 1
Total Number of Articles : 1
PubChem 2856
Molecular Formula

C16H19ClN6O

SMILES

CC(C)N1C=NC2=C(N=C(N=C21)NCCO)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H19ClN6O/c1-10(2)23-9-19-13-14(20-12-5-3-4-11(17)8-12)21-16(18-6-7-24)22-15(13)23/h3-5,8-10,24H,6-7H2,1-2H3,(H2,18,20,21,22)

synonyms
  • 212779-48-1
  • compound 52
  • NG 52
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Properties
Property Value
MW 346.81 g/mol
HBD 3
HBA 6
Rotatable Bond Count 6
Exact Mass 346.1308869 g/mol
Monoisotopic Mass 346.1308869 g/mol
Heavy Atom Count 24
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 401
xlogp 2.9
Topological Polar Surface Area 87.9