SMILES:
CCCCCCCCCC(=O)Oc1cc2c(cc1OC)CCN(C)C2C1(c2ccccc2Cl)CC1Molecular Processing
Molecular formula
C30H40ClNO3
Molecular weight
498.11
Exact mass
497.2697
XLogP
7.66
TPSA
38.77
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
12
Heavy atoms
35
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.567
Molar refractivity
142.68
Supplementary Information
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