الاسم: N-{2-[4-(4-fluorobenzoyl)piperidino]ethyl}-4-hydroxymethyl-N-(2-methoxyphenyl)benzene sulfonamide
SMILES:
COc1ccccc1N(CCN1CCC(C(=O)c2ccc(F)cc2)CC1)S(=O)(=O)c1ccc(CO)cc1Molecular Processing
Molecular formula
C28H31FN2O5S
Molecular weight
526.63
Exact mass
526.1938
XLogP
4.12
TPSA
87.15
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
37
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.321
Molar refractivity
139.79
Supplementary Information
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