SMILES:
CC1(C)C(C(=O)OCn2ccc(Cc3ccc(F)cc3)c2)C1C(Br)C(Cl)(Cl)BrMolecular Processing
Molecular formula
C20H20Br2Cl2FNO2
Molecular weight
556.1
Exact mass
552.9222
XLogP
6.28
TPSA
31.23
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
7
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
116.57
Supplementary Information
상세 정보 불러오는 중…
1개 반응에 참여→