SMILES:
CC(C)C(C(=O)OCc1cccc(Cc2ccccc2)n1)c1cc2cc(Cl)ccc2s1Molecular Processing
Molecular formula
C26H24ClNO2S
Molecular weight
450
Exact mass
449.1216
XLogP
7.02
TPSA
39.19
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
127.7
Supplementary Information
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