COc1ccccc1-c1ccc2c(c1)C(CNC(=O)c1ccccc1)=CC(C)(C)N2
SMILES: COc1ccccc1-c1ccc2c(c1)C(CNC(=O)c1ccccc1)=CC(C)(C)N2

Molecular Processing

Molecular formula
C26H26N2O2
Molecular weight
398.51
Exact mass
398.1994
XLogP
5.38
TPSA
50.36
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.192
Molar refractivity
122.88

Supplementary Information

Details werden geladen…

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