1-(Phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine

C₁₃H₁₀N₂O₂SCAS 143141-23-5258.30 g/mol

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Properties

Molecular formula: C₁₃H₁₀N₂O₂S
Molar mass: 258.30 g/mol
Exact mass: 258.0463 Da
logP: 2.27Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

Identifiers

CAS number

143141-23-5

SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2N=CC=C3

InChIKey

KEPQQULYWDIKEK-UHFFFAOYSA-N

InChI

InChI=1S/C13H10N2O2S/c16-18(17,12-6-2-1-3-7-12)15-10-8-11-5-4-9-14-13(11)15/h1-10H

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Names and synonyms

1 names

1H-Pyrrolo[2,3-B]pyridine, 1-(phenylsulfonyl)-

Work with 1-(Phenylsulfonyl)-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

1-(Phenylsulfonyl)-1H-pyrrole16851-82-443 % similar 4-Bromo-1-tosyl-1H-pyrrolo[2,3-B]pyridine348640-07-342 % similar 4-Bromo-2-iodo-1-(phenylsulfonyl)-1H-pyrrolo[2,3-B]pyridine889939-26-838 % similar N-Tosyl-5-bromo-4,7-diazaindole1201186-54-036 % similar 1-(Phenylsulfonyl)-1H-indol-3-ylboronic acid129271-98-335 % similar 5-(2-Fluorophenyl)-1-(3-pyridinylsulfonyl)-1H-pyrrole-3-carboxaldehyde881677-11-832 % similar Benzenesulfonamide98-10-232 % similar Ferroin14634-91-431 % similar

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

Elsewhere

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