8003-7569 Screening compound: N-(pyridin-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide

8003-7569 Screening compound: N-(pyridin-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide
8003-7569 Screening compound: N-(pyridin-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-7569
N-(pyridin-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)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

8003-7569

Molecular Formula

C9H9N5OS (C9 H9 N5 OS)

Compound Name

N-(pyridin-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide

IUPAC name

N-(pyridin-2-yl)-2-(1H-124-triazol-5-ylsulfanyl)acetamide

SMILES

O=C(CSc1ncn[nH]1)Nc1ncccc1

InChI

InChI=1S/C9H9N5OS/c15-8(5-16-9-11-6-12-14-9)13-7-3-1-2-4-10-7/h1-4,6H,5H2,(H,10,13,15)(H,11,12,14)

InChI Key

HCZYEPGBMOZJCO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00744880

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

235.27

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.611

Distribution Coefficient, logD

0.401

Water Solubility, LogSw

-2.15

Polar Surface Area

67.156

Acid Dissociation Constant (pKa)

7.61

Base Dissociation Constant (pKb)

2.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

8003-7569 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Others
  • Proteases

References: we are preparing a list of scientific research reports with 8003-7569 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-7569?
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What is the minimum amount of 8003-7569 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-7569
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-7569
  • 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 8003-7569 available by request