SMILES:
CCCc1nc(N2CCN(C(=O)Cc3ccccc3)CC2)c2cc(CC)sc2n1Molecular Processing
Molecular formula
C23H28N4OS
Molecular weight
408.57
Exact mass
408.1984
XLogP
4.1
TPSA
49.33
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
119.73
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→