名称: 3-(2-chloro-5-fluoro-4-pyridinyl)-5,5-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyridine

SMILES: CC1(CCN2C(=C(C=N2)C3=CC(=NC=C3F)Cl)C1)C

Molecular Processing

Molecular formula

C14H15ClFN3

Molecular weight

279.75

Exact mass

279.0939

XLogP

3.71

TPSA

30.71

H-bond donors

H-bond acceptors

Rotatable bonds

Heavy atoms

Rings

Aromatic rings

Saturated rings

Aliphatic rings

Stereo centers

Undefined stereo

Formal charge

Heteroatoms

Covalent units

Fraction Csp3

0.429

Molar refractivity

72.53

Supplementary Information

InChIKey: CTYXLXZLKXZIEV-UHFFFAOYSA-N

同義語

SCHEMBL18338335