CC(=O)N1C[C@H]2CC(c3ccc(OCCOc4cc(F)ccc4Cl)cc3)=C(C(=O)N(Cc3ccccc3Br)C3CC3)[C@@H](C1)N2.O=CO
SMILES: CC(=O)N1C[C@H]2CC(c3ccc(OCCOc4cc(F)ccc4Cl)cc3)=C(C(=O)N(Cc3ccccc3Br)C3CC3)[C@@H](C1)N2.O=CO

Molecular Processing

Molecular formula
C35H36BrClFN3O6
Molecular weight
729.04
Exact mass
727.146
XLogP
5.94
TPSA
108.41
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
47
Rings
6
Aromatic rings
3
Saturated rings
2
Aliphatic rings
3
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
2
Fraction Csp3
0.343
Molar refractivity
179.75

Supplementary Information

Details werden geladen…

An 1 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→