Name: 2-chlorobenzenesulfonic acid 3-[(piperidin-3-yl)methoxy]-5-methylphenyl ester
SMILES:
Cc1cc(OCC2CCCNC2)cc(OS(=O)(=O)c2ccccc2Cl)c1Molecular Processing
Molecular formula
C19H22ClNO4S
Molecular weight
395.91
Exact mass
395.0958
XLogP
3.79
TPSA
64.63
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
101.53
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→