SMILES:
CC(=O)N1C[C@H]2CC(c3ccc(OCCOc4cc(F)ccc4Cl)cc3)=C(C(=O)N(Cc3cccc(C)c3C)C3CC3)[C@@H](C1)N2.O=COMolecular Processing
Molecular formula
C37H41ClFN3O6
Molecular weight
678.2
Exact mass
677.2668
XLogP
5.79
TPSA
108.41
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
48
Rings
6
Aromatic rings
3
Saturated rings
2
Aliphatic rings
3
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
2
Fraction Csp3
0.378
Molar refractivity
181.53
Supplementary Information
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