SMILES:
CC1(C)C(=O)NC(=O)N1CCNc1ncc(-c2ccccc2)c(-c2ccc(Cl)s2)n1Molecular Processing
Molecular formula
C21H20ClN5O2S
Molecular weight
441.94
Exact mass
441.1026
XLogP
4.27
TPSA
87.22
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
118.6
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→