Name: 2-(4-aminophenyl)benzo[b]thiophene-3-yl 4-[2-(1-pyrrolidinyl)ethoxy]phenyl ketone
SMILES:
Nc1ccc(-c2sc3ccccc3c2C(=O)c2ccc(OCCN3CCCC3)cc2)cc1Molecular Processing
Molecular formula
C27H26N2O2S
Molecular weight
442.58
Exact mass
442.1715
XLogP
5.86
TPSA
55.56
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
32
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
132.72
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→