L776-1072 Screening compound: 5-(2,4-difluorobenzenesulfonyl)-3-[(4-fluorophenoxy)methyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine

L776-1072 Screening compound: 5-(2,4-difluorobenzenesulfonyl)-3-[(4-fluorophenoxy)methyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine
L776-1072 Screening compound: 5-(2,4-difluorobenzenesulfonyl)-3-[(4-fluorophenoxy)methyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound L776-1072
5-(2,4-difluorobenzenesulfonyl)-3-[(4-fluorophenoxy)methyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

L776-1072

Molecular Formula

C20H18F3N3O3S (C20 H18 F3 N3 O3 S)

Compound Name

5-(2,4-difluorobenzenesulfonyl)-3-[(4-fluorophenoxy)methyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine

IUPAC name

5-(24-difluorobenzenesulfonyl)-3-[(4-fluorophenoxy)methyl]-1-methyl-1H4H5H6H7H-pyrazolo[43-c]pyridine

SMILES

Cn1nc(COc(cc2)ccc2F)c(C2)c1CCN2S(c(ccc(F)c1)c1F)(=O)=O

InChI

InChI=1S/C20H18F3N3O3S/c1-25-19-8-9-26(30(27,28)20-7-4-14(22)10-17(20)23)11-16(19)18(24-25)12-29-15-5-2-13(21)3-6-15/h2-7,10H,8-9,11-12H2,1H3

InChI Key

OBPYXVHUGFCMAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27474571

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.988

Distribution Coefficient, logD

2.988

Water Solubility, LogSw

-3.41

Polar Surface Area

54.352

Acid Dissociation Constant (pKa)

22.23

Base Dissociation Constant (pKb)

-0.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

L776-1072 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Cysteine Proteases Inhibitors Library (7839 compounds)

Hsp90-Targeted Library (11355 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Targets:
  • Proteases
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L776-1072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L776-1072?
Check Price and Availability of L776-1072, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L776-1072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L776-1072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L776-1072
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of L776-1072 available by request