C1=CC2=C(C(=NN2C=C1)C3=CC(=CC=C3)NC(=O)C4=C(C=CC=C4F)F)C5=NC(=NC=C5)Cl
이름: N-[3-[3-(2-chloropyrimidin-4-yl)pyrazolo[1,5-a]pyridin-2-yl]phenyl]-2,6-difluorobenzamide
SMILES: C1=CC2=C(C(=NN2C=C1)C3=CC(=CC=C3)NC(=O)C4=C(C=CC=C4F)F)C5=NC(=NC=C5)Cl

Molecular Processing

Molecular formula
C24H14ClF2N5O
Molecular weight
461.86
Exact mass
461.0855
XLogP
5.64
TPSA
72.18
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
33
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0
Molar refractivity
120.98

Supplementary Information

InChIKey: DTCUCXBUZICCMP-UHFFFAOYSA-N
동의어
SCHEMBL3441847DTCUCXBUZICCMP-UHFFFAOYSA-NN-{3-[3-(2-Chloro-4-pyrimidinyl)pyrazolo[1,5-a]pyridin-2-yl]phenyl}-2,6-difluorobenzamideN-{3-[3-(2-chloro-4-pyrimidinyl)pyrazolo-[1,5-a]pyridin-2-yl]phenyl}-2,6-difluorobenzamide
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