Name: (4R/S)-4-[(4-amino-1-piperidinyl)methyl]-3,4-difluoro-4,5-dihydro-7H-pyrrolo[3,2,1-de]-1,5-naphthyridin-7-one dihydrochloride
SMILES:
Cl.Cl.NC1CCN(CC2(F)Cn3c(=O)ccc4ncc(F)c2c43)CC1Molecular Processing
Molecular formula
C16H20Cl2F2N4O
Molecular weight
393.27
Exact mass
392.0982
XLogP
1.98
TPSA
64.15
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
3
Fraction Csp3
0.5
Molar refractivity
96.89
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→