Nom: ethyl 1-ethyl-8-(4-methylpiperazin-1-yl)-6,7,9-trifluoro-4H-quinolizin-4-one-3-carboxylate
SMILES:
CCOC(=O)c1cc(CC)c2c(F)c(N3CCN(C)CC3)c(F)c(F)n2c1=OMolecular Processing
Molecular formula
C19H22F3N3O3
Molecular weight
397.4
Exact mass
397.1613
XLogP
2.21
TPSA
54.26
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.474
Molar refractivity
98.59
Supplementary Information
Récupération des détails…
Impliqué dans 5 réactions→