Name: (1-benzyl-1H-indazol-5-yl)-(4-chloro-[1,3,5]triazin-2-yl)amine
SMILES:
Clc1ncnc(Nc2ccc3c(cnn3Cc3ccccc3)c2)n1Molecular Processing
Molecular formula
C17H13ClN6
Molecular weight
336.79
Exact mass
336.089
XLogP
3.67
TPSA
68.52
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
24
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.059
Molar refractivity
93.4
Supplementary Information
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Involved in 11 reactions→