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CS-W001157 4
Total: USD 88.00

1-(Benzenesulfonyl)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine

  • CAS No. 942919-24-6

  • Cat. No. CS-0004197
  • Purity98+%
  • MDL No.MFCD10574997

*For research and further manufacturing use only, not for direct human use.

1-(Benzenesulfonyl)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine|CS-0004197

Structure of 942919-24-6

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General Information

  • CAS No. 942919-24-6
  • Cat. No. CS-0004197
  • Purity 98+%
  • MDL No. MFCD10574997
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₉H₂₁BN₂O₄S
  • Molecular Weight 384.26
  • Synonym(s) 1-(Phenylsulfonyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)-1H-pyrrolo[2,3-B]pyridine
  • SMILES O=S(N1C2=NC=CC(B(OC(C)3C)OC3(C)C)=C2C=C1)(C4=CC=CC=C4)=O

Synthesis

  • Route1

    References

    • Adams, Nicholas D.; Adams, Jerry L.; Burgess, Joelle L.; Chaudhari, Amita M.; Copeland, Robert A.; Donatelli, Carla A.; Drewry, David H.; Fisher, Kelly E.; Hamajima, Toshihiro; Hardwicke, Mary Ann; Huffman, William F.; Koretke-Brown, Kristin K.; Lai, Zhihong V.; McDonald, Octerloney B.; Nakamura, Hiroko; Newlander, Ken A.; Oleykowski, Catherine A.; Parrish, Cynthia A.; Patrick, Denis R.; Plant, Ramona; Sarpong, Martha A.; Sasaki, Kosuke; Schmidt, Stanley J.; Silva, Domingos J.; Sutton, David; Tang, Jun; Thompson, Christine S.; Tummino, Peter J.; Wang, Jamin C.; Xiang, Hong; Yang, Jingsong; Dhanak, Dashyant Journal of Medicinal Chemistry, 2010 , vol. 53, # 10 p. 3973 - 4001
  • Route2

    References

    • Chang, Shaohua; Zhang, Zhang; Zhuang, Xiaoxi; Luo, Jinfeng; Cao, Xianwen; Li, Honglin; Tu, Zhengchao; Lu, Xiaoyun; Ren, Xiaomei; Ding, Ke Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 2 p. 1208 - 1212
  • Route3

    References

    • Chang, Shaohua; Zhang, Zhang; Zhuang, Xiaoxi; Luo, Jinfeng; Cao, Xianwen; Li, Honglin; Tu, Zhengchao; Lu, Xiaoyun; Ren, Xiaomei; Ding, Ke Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 2 p. 1208 - 1212

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   70.42
  • LogP   2.5725
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   3

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