4-Chloro-3-fluoro-1H-pyrrolo[2,3-B]pyridine

C₇H₄ClFN₂CAS 1211582-49-8170.57 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₄ClFN₂
Molar mass: 170.57 g/mol
Exact mass: 170.0047 Da
logP: 2.36Crippen estimate
Polar surface area: 28.7 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

1211582-49-8

SMILES

C1=CN=C2C(=C1Cl)C(=CN2)F

InChIKey

FWZLZMBIFJYSAU-UHFFFAOYSA-N

InChI

InChI=1S/C7H4ClFN2/c8-4-1-2-10-7-6(4)5(9)3-11-7/h1-3H,(H,10,11)

Weigh it out

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Work with 4-Chloro-3-fluoro-1H-pyrrolo[2,3-B]pyridine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-Bromo-4-chloro-1H-pyrrolo[2,3-B]pyridine1000340-39-560 % similar 4-Chloro-3-methyl-1H-pyrrolo[2,3-B]pyridine688782-02-760 % similar 3,4-Dibromo-7-azaindole1000340-33-941 % similar 4,5-Dichloro-7H-pyrrolo[2,3-D]pyrimidine115093-90-839 % similar 4-Chloro-3-fluoropyridine hcl119229-74-237 % similar 7-Chloro-1H-pyrrolo[3,2-B]pyridine357263-48-037 % similar 4,7-Dichloro-1,10-phenanthroline5394-23-034 % similar 4-Fluoro-1H-pyrrolo[2,3-B]pyridine640735-23-534 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

6-Chloro-5-fluoro-1H-pyrrolo[2,3-B]pyridine1190321-96-0 6-Chloro-5-fluoro-1H-benzimidazole175135-04-3 4-Amino-2-chloro-3-fluorobenzonitrile757247-99-7 4-Chloro-5-fluoro-1H-pyrrolo[2,3-B]pyridine882033-66-1

Elsewhere

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