Name: 3-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenoxy]-17-(3-pyridyl)androsta-3,5,16-triene
SMILES:
C[C@]12CCC(Oc3c(F)c(F)c(C(F)(F)F)c(F)c3F)=CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(c3cccnc3)=CC[C@@H]12Molecular Processing
Molecular formula
C31H28F7NO
Molecular weight
563.56
Exact mass
563.2059
XLogP
9.19
TPSA
22.12
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
40
Rings
6
Aromatic rings
2
Saturated rings
1
Aliphatic rings
4
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.452
Molar refractivity
134.67
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→