SMILES:
CN1C(=O)CCC2(C)c3ccc(Sc4nc5c(Cl)cccc5s4)cc3CCC12Molecular Processing
Molecular formula
C22H21ClN2OS2
Molecular weight
429.01
Exact mass
428.0784
XLogP
5.93
TPSA
33.2
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
28
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
116.66
Supplementary Information
Obteniendo detalles…
Participa en 1 reacciones→