8019-5139 Screening compound: N-(5-bromopyridin-2-yl)-2-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]acetamide

8019-5139 Screening compound: N-(5-bromopyridin-2-yl)-2-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]acetamide
8019-5139 Screening compound: N-(5-bromopyridin-2-yl)-2-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-5139
N-(5-bromopyridin-2-yl)-2-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]acetamide

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

8019-5139

Molecular Formula

C12H13BrN4OS (C12 H13 BrN4 OS)

Compound Name

N-(5-bromopyridin-2-yl)-2-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]acetamide

IUPAC name

N-(5-bromopyridin-2-yl)-2-[(45-dimethyl-1H-imidazol-2-yl)sulfanyl]acetamide

SMILES

Cc([nH]1)c(C)nc1SCC(Nc(cc1)ncc1Br)=O

InChI

InChI=1S/C12H13BrN4OS/c1-7-8(2)16-12(15-7)19-6-11(18)17-10-4-3-9(13)5-14-10/h3-5H,6H2,1-2H3,(H,15,16)(H,14,17,18)

InChI Key

PMNJNXOUFFGFKM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10038030

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.23

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.625

Distribution Coefficient, logD

2.590

Water Solubility, LogSw

-2.87

Polar Surface Area

52.286

Acid Dissociation Constant (pKa)

9.12

Base Dissociation Constant (pKb)

6.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

8019-5139 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Targets:
  • Proteases
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with 8019-5139 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-5139?
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What is the minimum amount of 8019-5139 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-5139
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-5139
  • 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 8019-5139 available by request