Name: 11-(3-chloro-4-fluorobenzyl)-9-methoxy-2-(2-morpholin-4-ylethyl)-3,4,5,6,12,13-hexahydro-2H[1,4]diazocino[2,1-a]-2,6-naphthyridine-1,8,10(11H)-trione
SMILES:
COc1c2c(c3n(c1=O)CCCCN(CCN1CCOCC1)C3=O)CCN(Cc1ccc(F)c(Cl)c1)C2=OMolecular Processing
Molecular formula
C27H32ClFN4O5
Molecular weight
547.03
Exact mass
546.2045
XLogP
2.42
TPSA
84.32
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
38
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.519
Molar refractivity
139.5
Supplementary Information
Details werden geladen…
An 5 Reaktionen beteiligt→