이름: 2-chloro-5-[3-[(methylsulfonyl)oxy]propyl]-N-(tricyclo[3.3.1.13,7]dec-1-ylmethyl)-benzamide
SMILES:
CS(=O)(=O)OCCCc1ccc(Cl)c(C(=O)NCC23CC4CC(CC(C4)C2)C3)c1Molecular Processing
Molecular formula
C22H30ClNO4S
Molecular weight
440.01
Exact mass
439.1584
XLogP
4.2
TPSA
72.47
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
29
Rings
5
Aromatic rings
1
Saturated rings
4
Aliphatic rings
4
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.682
Molar refractivity
113.51
Supplementary Information
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