CN(C)C(=O)C1=C2CCN(C(=O)C2=C(C(=O)N1)O)CC3=CC(=C(C=C3)F)Cl
Название: 6-[(3-chloro-4-fluorophenyl)methyl]-4-hydroxy-N,N-dimethyl-3,5-dioxo-7,8-dihydro-2H-2,6-naphthyridine-1-carboxamide
SMILES: CN(C)C(=O)C1=C2CCN(C(=O)C2=C(C(=O)N1)O)CC3=CC(=C(C=C3)F)Cl

Molecular Processing

Molecular formula
C18H17ClFN3O4
Molecular weight
393.8
Exact mass
393.0892
XLogP
1.77
TPSA
93.71
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
96.6

Supplementary Information

InChIKey: LGVXTZGDNYSNSU-UHFFFAOYSA-N
Синонимы
SCHEMBL1335730SCHEMBL4487029LGVXTZGDNYSNSU-UHFFFAOYSA-N6-(3-Chloro-4-fluorobenzyl)-3,4-dihydroxy-N,N-dimethyl-5-oxo-5,6,7,8-tetrahydro-2,6-naphthyridine-1-carboxamide6-(3-chloro-4-fluorobenzyl)-4-hydroxy-N,N-dimethyl-3,5-dioxo-2,3,5,6,7,8-hexahydro-2,6-naphthyridine-1-carboxamide
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