SMILES:
O=C(CC1c2ccccc2-c2ccccc2N1S(=O)(=O)c1ccc(Cl)c(Cl)c1)NCCCN1CCN(c2ccncc2)CC1Molecular Processing
Molecular formula
C33H33Cl2N5O3S
Molecular weight
650.63
Exact mass
649.1681
XLogP
6.02
TPSA
85.85
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
44
Rings
6
Aromatic rings
4
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
175.88
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→