SMILES:
COc1cc(C)cc(C)c1-c1cccc2c(N(CC3CCOCC3)CC3CC3)c(SC)nn12Molecular Processing
Molecular formula
C27H35N3O2S
Molecular weight
465.66
Exact mass
465.245
XLogP
5.99
TPSA
39
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
33
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.519
Molar refractivity
136.91
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→