이름: 4′-{[4-butyl-1-(3-fluoro-4-methoxyphenyl)-2-methyl-6-oxo-1,6-dihydropyrimidin-5-yl]methyl}biphenyl-2-carbonitrile
SMILES:
CCCCc1nc(C)n(-c2ccc(OC)c(F)c2)c(=O)c1Cc1ccc(-c2ccccc2C#N)cc1Molecular Processing
Molecular formula
C30H28FN3O2
Molecular weight
481.57
Exact mass
481.2166
XLogP
6.16
TPSA
67.91
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
36
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.233
Molar refractivity
139.09
Supplementary Information
상세 정보 불러오는 중…
5개 반응에 참여→