SMILES:
CCC[C@H]1CN(Cc2cc(Cl)ccc2OCC(=O)O)CCN1C(=O)Cc1ccccc1Molecular Processing
Molecular formula
C24H29ClN2O4
Molecular weight
444.96
Exact mass
444.1816
XLogP
3.86
TPSA
70.08
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
9
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
120.41
Supplementary Information
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