Nombre: 7-(2-Dimethylaminoethyl)amino-9-(1,1-ethylenedioxy)ethyl-6,9-dihydroxy-5,7,8,9,10,12-hexahydronaphthacene-5,12-dione
SMILES:
CCC1C=CC2=C(C(=O)c3cc4c(c(O)c3C2=O)C(NCCN(C)C)CC(O)C4)C12OCCO2Molecular Processing
Molecular formula
C26H32N2O6
Molecular weight
468.55
Exact mass
468.226
XLogP
1.91
TPSA
108.33
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
34
Rings
5
Aromatic rings
1
Saturated rings
1
Aliphatic rings
4
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
124.98
Supplementary Information
Obteniendo detalles…
Participa en 3 reacciones→