Name: (E)-6-chloro-5,8-dimethyl-2-(2-(1-methyl-3-(pyrrolidin-1-yl)-1H-1,2,4-triazol-5-yl)vinyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILES:
Cc1cc(Cl)c(C)n2nc(/C=C/c3nc(N4CCCC4)nn3C)nc12Molecular Processing
Molecular formula
C17H20ClN7
Molecular weight
357.85
Exact mass
357.1469
XLogP
2.9
TPSA
64.14
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
25
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
98.85
Supplementary Information
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