SMILES:
Clc1cc(OC2CCCCO2)ccc1CNc1ccc(OCCN2CCCC2)cc1Molecular Processing
Molecular formula
C24H31ClN2O3
Molecular weight
430.98
Exact mass
430.2023
XLogP
5.33
TPSA
42.96
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
30
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
120.61
Supplementary Information
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