Name: Compound 7a
SMILES:
COC(=O)CCNC(=O)c1ccc(-c2c(/C=C/c3ccc4ccccc4n3)nc3c(N4CCOCC4)ccnn23)cc1Molecular Processing
Molecular formula
C32H30N6O4
Molecular weight
562.63
Exact mass
562.2329
XLogP
4.24
TPSA
110.95
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
42
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.219
Molar refractivity
161.09
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→