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918504-61-7

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Basic Information
CAS No.: 918504-61-7
Name: N-[2,4-Difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]benzenesulfonamide
Molecular Structure:
Molecular Structure of 918504-61-7 (N-[2,4-Difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]benzenesulfonamide)
Formula: C25H16 F2 N4 O3 S
Molecular Weight: 490.49
Synonyms: Benzenesulfonamide,-[2,4-difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]-;Benzenesulfonamide, N-[2,4-difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]-;N-[2,4-Difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]benzenesulfonamide
Density: 1.46
PSA: 113.19000
LogP: 6.08870
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  • Benzenesulfonamide,-[2,4-difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]-

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    Benzenesulfonamide,-[2,4-difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]-

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Chemistry


Systematic Name: benzenesulfonamide, N-[2,4-Difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]- SMILES: c1ccc(cc1)S(=O)(=O)Nc2ccc(c(c2F)C(=O)c3c[nH]c4c3cc(cn4)c5cccnc5)F
InChI: InChI=1/C25H16F2N4O3S/c26-20-8-9-21(31-35(33,34)17-6-2-1-3-7-17)23(27)22(20)24(32)19-14-30-25-18(19)11-16(13-29-25)15-5-4-10-28-12-15/h1-14,31H,(H,29,30)
InChIKey: VVOQVEWYXOKLLQ-UHFFFAOYAZ 
Empirical Formula: C25H16F2N4O3S
Molecular Weight: 490.48
Nominal Mass: 490
Average Mass: 490.4813
Monoisotopic Mass: 490.091117 
H bond acceptors: 7
H bond donors: 2
Freely Rotating Bonds: 5
Index of Refraction: 1.686
Molar Refractivity: 125.39 cm3
Molar Volume: 329.2 cm3
Surface Tension: 68.3 dyne/cm
Density: 1.489 g/cm3
Flash Point: 415.3 °C
Enthalpy of Vaporization: 111.13 kJ/mol
Boiling Point: 763.1 °C at 760 mmHg
Vapour Pressure: 3.43E-23 mmHg at 25 °C
Product Categories of N-[2,4-Difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]benzenesulfonamide (CAS NO.918504-61-7):  API intermediates

Specification

  N-[2,4-Difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]benzenesulfonamide (CAS NO.918504-61-7), its Synonyms are Benzenesulfonamide,-[2,4-difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]- ; Benzenesulfonamide, N-[2,4-difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]- .