Name: (1-pyridin-2-yl-1H-pyrazol-4-yl)-carbamic acid tert-butyl ester
SMILES:
CC(C)(C)OC(=O)Nc1cnn(-c2ccccn2)c1Molecular Processing
Molecular formula
C13H16N4O2
Molecular weight
260.3
Exact mass
260.1273
XLogP
2.61
TPSA
69.04
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
71.22
Supplementary Information
Details werden geladen…
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