名称: tert-butyl 4-[6-(6-chloropyrazolo[4,3-c]pyridin-1-yl)-2-pyridyl]-3,6-dihydro-2H-pyridine-1-carboxylate
SMILES:
CC(C)(C)OC(=O)N1CC=C(c2cccc(-n3ncc4cnc(Cl)cc43)n2)CC1Molecular Processing
Molecular formula
C21H22ClN5O2
Molecular weight
411.89
Exact mass
411.1462
XLogP
4.49
TPSA
73.14
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
112.07
Supplementary Information
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