SMILES:
CC1COCCN1c1cc(C(C)(C)S(=O)(=O)C2CCCCC2)nc(Cl)n1Molecular Processing
Molecular formula
C18H28ClN3O3S
Molecular weight
401.96
Exact mass
401.154
XLogP
3.34
TPSA
72.39
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
26
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
103.49
Supplementary Information
Details werden geladen…
An 1 Reaktionen beteiligt→