Name: Tert-butyl 4-(3-(5-(pyridin-3-yl)-1-(tetrahydro-2H-pyran-2-yl)-1H-pyrazolo[3,4-c]pyridin-3-yl)-1H-pyrazol-1-yl)piperidine-1-carboxylate
SMILES:
CC(C)(C)OC(=O)N1CCC(n2ccc(-c3nn(C4CCCCO4)c4cnc(-c5cccnc5)cc34)n2)CC1Molecular Processing
Molecular formula
C29H35N7O3
Molecular weight
529.65
Exact mass
529.2801
XLogP
5.63
TPSA
100.19
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
39
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.483
Molar refractivity
146.9
Supplementary Information
Details werden geladen…
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