CC(COC1CCCCO1)C2=NC=C(C(=C2F)Cl)F
Название: 4-chloro-3,5-difluoro-2-[1-(oxan-2-yloxy)propan-2-yl]pyridine
SMILES: CC(COC1CCCCO1)C2=NC=C(C(=C2F)Cl)F

Molecular Processing

Molecular formula
C13H16ClF2NO2
Molecular weight
291.72
Exact mass
291.0838
XLogP
3.66
TPSA
31.35
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
67.12

Supplementary Information

InChIKey: KSRSNEIMSCWYFA-UHFFFAOYSA-N
Синонимы
SCHEMBL8122602KSRSNEIMSCWYFA-UHFFFAOYSA-N4-Chloro-3,5-difluoro-2-(1-(2-tetrahydropyranyl)oxy-2-propy)pyridine4-Chloro-3,5-difluoro-2-(1-(2-tetrahydropyranyl)oxy-2-propyl)pyridine
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