Name: 2-[(trans-4-{6-[(2′-cyanobiphenyl-4-yl)methyl]-5-oxo-7-propylpyrazolo[1,5-a]pyrimidin-4(5H)-yl}cyclohexyl)oxy]-N-methoxy-N-methylacetamide
SMILES:
CCCc1c(Cc2ccc(-c3ccccc3C#N)cc2)c(=O)n([C@H]2CC[C@H](OCC(=O)N(C)OC)CC2)c2ccnn12Molecular Processing
Molecular formula
C33H37N5O4
Molecular weight
567.69
Exact mass
567.2846
XLogP
5.1
TPSA
101.86
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
42
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.394
Molar refractivity
159.87
Supplementary Information
Details werden geladen…
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