Nombre: tert-butyl 3-((7-(4-((2-ethoxy-2-oxoethyl)(methyl)amino)phenyl)pyrido[4,3-b]pyrazin-5-ylamino)methyl)-4,4-difluoropiperidine-1-carboxylate
SMILES:
CCOC(=O)CN(C)c1ccc(-c2cc3nccnc3c(NCC3CN(C(=O)OC(C)(C)C)CCC3(F)F)n2)cc1Molecular Processing
Molecular formula
C29H36F2N6O4
Molecular weight
570.64
Exact mass
570.2766
XLogP
5
TPSA
109.78
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
8
Heavy atoms
41
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.483
Molar refractivity
152.02
Supplementary Information
Obteniendo detalles…
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