SMILES:
CC1(Cc2ccc(OC(F)(F)F)cc2)C(=O)N(c2cc(Cl)cc(Cl)c2)c2ncc(I)n21Molecular Processing
Molecular formula
C20H13Cl2F3IN3O2
Molecular weight
582.15
Exact mass
580.9382
XLogP
6.33
TPSA
47.36
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
119.03
Supplementary Information
상세 정보 불러오는 중…
1개 반응에 참여→