SMILES:
CC#CCOc1ccc(S(=O)(=O)C2(C(=O)NO)CCCN(Cc3ccc(Cl)cc3)C2)cc1Molecular Processing
Molecular formula
C23H25ClN2O5S
Molecular weight
476.98
Exact mass
476.1173
XLogP
3.06
TPSA
95.94
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
32
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
121.2
Supplementary Information
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