N=C(NC(=O)OCC(Cl)(Cl)Cl)c1cccc(CN2CC[C@H](NS(=O)(=O)c3cc4c(Cl)cc(Cl)cc4s3)C2=O)c1
SMILES: N=C(NC(=O)OCC(Cl)(Cl)Cl)c1cccc(CN2CC[C@H](NS(=O)(=O)c3cc4c(Cl)cc(Cl)cc4s3)C2=O)c1

Molecular Processing

Molecular formula
C23H19Cl5N4O5S2
Molecular weight
672.83
Exact mass
669.924
XLogP
5.71
TPSA
128.66
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
39
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
16
Covalent units
1
Fraction Csp3
0.261
Molar refractivity
154.03

Supplementary Information

Obteniendo detalles…

Participa en 2 reacciones→

Busqueda Extendida

Busqueda de Subestructura→Busqueda de Similitud→