SMILES:
CC(C)(C)OC(=O)CC(=O)c1cccc(-c2ccnc(COC3CCCCO3)c2)c1Molecular Processing
Molecular formula
C24H29NO5
Molecular weight
411.5
Exact mass
411.2046
XLogP
4.71
TPSA
74.72
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
112.85
Supplementary Information
Details werden geladen…
An 14 Reaktionen beteiligt→