CC(=O)OC(COCCN(C)C)c1ccc2cc(OCc3ccccc3)ccc2c1.Cl
Name: 1-acetoxy-1-(6-benzyloxy-2-naphthyl)-2-[2-(N,N-dimethylamino)ethoxy]-ethane hydrochloride
SMILES: CC(=O)OC(COCCN(C)C)c1ccc2cc(OCc3ccccc3)ccc2c1.Cl

Molecular Processing

Molecular formula
C25H30ClNO4
Molecular weight
443.97
Exact mass
443.1863
XLogP
5.02
TPSA
48
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.32
Molar refractivity
125.85

Supplementary Information

Details werden geladen…

An 12 Reaktionen beteiligt