8015-0167 Screening compound: N-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide

8015-0167 Screening compound: N-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
8015-0167 Screening compound: N-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-0167
N-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-[(4-methyl-4H-1,2,4-triazol-3-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

8015-0167

Molecular Formula

C9H11N7O3S (C9 H11 N7 O3 S)

Compound Name

N-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide

IUPAC name

N-(4-acetamido-125-oxadiazol-3-yl)-2-[(4-methyl-4H-124-triazol-3-yl)sulfanyl]acetamide

SMILES

CC(Nc1nonc1NC(CSc1nncn1C)=O)=O

InChI

InChI=1S/C9H11N7O3S/c1-5(17)11-7-8(15-19-14-7)12-6(18)3-20-9-13-10-4-16(9)2/h4H,3H2,1-2H3,(H,11,14,17)(H,12,15,18)

InChI Key

LVDSKWBNKVNWQN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03821705

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.3

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.558

Distribution Coefficient, logD

-2.247

Water Solubility, LogSw

-1.60

Polar Surface Area

109.041

Acid Dissociation Constant (pKa)

5.72

Base Dissociation Constant (pKb)

3.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

8015-0167 in Drug Discovery

Included in Screening Libraries

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

Protein Arginine Methyltransferases Library (27925 compounds)

Soluble Diversity Library (15920 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8015-0167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-0167?
Check Price and Availability of 8015-0167, 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 8015-0167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-0167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-0167
  • 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 8015-0167 available by request