N-De(4-sulfonaMidophenyl)-N'-(4-sulfonaMidophenyl) Celecoxib
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- Product name: N-De(4-sulfonaMidophenyl)-N'-(4-sulfonaMidophenyl) Celecoxib
- CAS: 331943-04-5
- MF: C17H14F3N3O2S
- MW: 381.37
- EINECS:
- MDL Number:MFCD21363468
- Synonyms:Celecoxib Related Compound B (10 mg) (4-[3-(4-methylphenyl)-5-(trifluoromethyl)-1H-pyrazol-1-yl]benzenesulfonamide);4-[3-(4-Methylphenyl)-5-(trifluoroMethyl)-1H-pyrazol-1-yl]benzenesulfonaMide;BenzenesulfonaMide, 4-[3-(4-Methylphenyl)-5-(trifluoroMethyl)-1H-pyrazol-1-yl]-;Celecoxib Related CoMpound B;N-De(4-sulfonamidophenyl)-Na€-(4-sulfonamidophenyl) Celecoxib;Celecoxib EP Impurity B (CelecoxibregioIsomer);Celecoxib Impurity 4(Celecoxib EP Impurity B);4-(3-(p-tolyl)-5-(trifluoromethyl)-1H-pyrazol-1-yl) benzenesulfonamide
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Properties
Melting point :182 - 187°C
Boiling point :529.0±60.0 °C(Predicted)
Density :1.43±0.1 g/cm3(Predicted)
storage temp. :Refrigerator
solubility :DMSO (Sparingly), Ethyl Acetate (Slightly), Methanol (Slightly)
pka :9.68±0.10(Predicted)
color :Off-White to Brown
InChI :InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)23(22-15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)
InChIKey :LGIMTMFJBCXYRP-UHFFFAOYSA-N
SMILES :C1(S(N)(=O)=O)=CC=C(N2C(C(F)(F)F)=CC(C3=CC=C(C)C=C3)=N2)C=C1
Boiling point :529.0±60.0 °C(Predicted)
Density :1.43±0.1 g/cm3(Predicted)
storage temp. :Refrigerator
solubility :DMSO (Sparingly), Ethyl Acetate (Slightly), Methanol (Slightly)
pka :9.68±0.10(Predicted)
color :Off-White to Brown
InChI :InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)23(22-15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)
InChIKey :LGIMTMFJBCXYRP-UHFFFAOYSA-N
SMILES :C1(S(N)(=O)=O)=CC=C(N2C(C(F)(F)F)=CC(C3=CC=C(C)C=C3)=N2)C=C1
Safety Information
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| Signal word: | Warning | ||||||||||||||
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Description
N-De(4-sulfonamidophenyl)-N’-(4-sulfonamidophenyl) Celecoxib (Celecoxib EP Impurity B) is an isomeric impurity of Celecoxib (C251000) with selective inhibitory activity against human cyclooxygenase-2. USP Celecoxib Related Compound BRelated product price
- 720-94-5
₹6100-18700 - Celecoxib
₹2600-36707.58 - 4'-Methylacetophenone
₹510-10970.01




