SMILES:
O=C(c1cnc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)s1)c1ccccc1ClMolecular Processing
Molecular formula
C21H15ClN2O4S
Molecular weight
426.88
Exact mass
426.0441
XLogP
4.43
TPSA
77.52
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
29
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
109.11
Supplementary Information
Details werden geladen…
An 9 Reaktionen beteiligt→