SMILES:
CC(C)(C)OC(=O)N1CCCC(C(OCC#N)c2ccc(F)c(Cl)c2)C1Molecular Processing
Molecular formula
C19H24ClFN2O3
Molecular weight
382.86
Exact mass
382.1459
XLogP
4.71
TPSA
62.56
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
26
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.579
Molar refractivity
96.25
Supplementary Information
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