8019-4876 Screening compound: 2-{[5-(4-amino-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide

8019-4876 Screening compound: 2-{[5-(4-amino-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide
8019-4876 Screening compound: 2-{[5-(4-amino-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-4876
2-{[5-(4-amino-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide

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

8019-4876

Molecular Formula

C13H19N7O2S (C13 H19 N7 O2 S)

Compound Name

2-{[5-(4-amino-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide

IUPAC name

2-{[5-(4-amino-125-oxadiazol-3-yl)-4-ethyl-4H-124-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide

SMILES

CCn1c(SCC(NC2CCCC2)=O)nnc1-c1nonc1N

InChI

InChI=1S/C13H19N7O2S/c1-2-20-12(10-11(14)19-22-18-10)16-17-13(20)23-7-9(21)15-8-5-3-4-6-8/h8H,2-7H2,1H3,(H2,14,19)(H,15,21)

InChI Key

IGTSWNIMWOVOSZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07790199

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.438

Distribution Coefficient, logD

1.438

Water Solubility, LogSw

-1.92

Polar Surface Area

105.613

Acid Dissociation Constant (pKa)

16.42

Base Dissociation Constant (pKb)

2.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.50

8019-4876 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 8019-4876 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-4876?
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What is the minimum amount of 8019-4876 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-4876
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-4876
  • 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 8019-4876 available by request