이름: (4S,5R)-5-[3,5-bis(trifluoromethyl)phenyl]-3-[(4-bromo-4′-fluoro-5′-isopropyl-2′-methoxybiphenyl-2-yl)methyl]-4-methyl-1,3-oxazolidin-2-one
SMILES:
COc1cc(F)c(C(C)C)cc1-c1ccc(Br)cc1CN1C(=O)O[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1CMolecular Processing
Molecular formula
C29H25BrF7NO3
Molecular weight
648.41
Exact mass
647.0906
XLogP
9.51
TPSA
38.77
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
41
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.345
Molar refractivity
140.85
Supplementary Information
상세 정보 불러오는 중…
10개 반응에 참여→