SMILES:
CC(=CC1=C(C(=O)OC(c2ccccc2)c2ccccc2)N2C(=O)C(N)C2S(=O)C1)Sc1nnc(C)s1Molecular Processing
Molecular formula
C26H24N4O4S3
Molecular weight
552.7
Exact mass
552.096
XLogP
3.69
TPSA
115.48
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
37
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
143.72
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→