SMILES:
O=C(Cc1ccccc1Cl)NC1CCN(CC23CC(c4ccccc42)c2ccccc23)CC1Molecular Processing
Molecular formula
C29H29ClN2O
Molecular weight
457.02
Exact mass
456.1968
XLogP
5.3
TPSA
32.34
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
33
Rings
6
Aromatic rings
3
Saturated rings
1
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.345
Molar refractivity
132.88
Supplementary Information
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