Name: 4′-{[1-(4-methoxyphenyl)-2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl]methyl}biphenyl-2-carbonitrile
SMILES:
CCCc1nc(C)n(-c2ccc(OC)cc2)c(=O)c1Cc1ccc(-c2ccccc2C#N)cc1Molecular Processing
Molecular formula
C29H27N3O2
Molecular weight
449.55
Exact mass
449.2103
XLogP
5.63
TPSA
67.91
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
34
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.207
Molar refractivity
134.52
Supplementary Information
Details werden geladen…
An 8 Reaktionen beteiligt→