SMILES:
C=CCC(CNC)(c1ccc(Cl)c(Cl)c1)N(C)C(=O)OC(C)(C)CMolecular Processing
Molecular formula
C18H26Cl2N2O2
Molecular weight
373.32
Exact mass
372.1371
XLogP
4.85
TPSA
41.57
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
24
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
100.88
Supplementary Information
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