الاسم: 2-(ethoxycarbonyloxy)-3-[4-({(2E)-3-[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-4-yl]-2-propenoyl}amino)phenyl]propionamide
SMILES:
CCOC(=O)OC(Cc1ccc(NC(=O)/C=C/c2cnn(C)c2-c2ccc(F)cc2)cc1)C(N)=OMolecular Processing
Molecular formula
C25H25FN4O5
Molecular weight
480.5
Exact mass
480.1809
XLogP
3.45
TPSA
125.54
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
35
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
127.5
Supplementary Information
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