8018-9606 Screening compound: N-(2-{[3-(5-bromofuran-2-yl)-1,2,4-oxadiazol-5-yl]formamido}ethyl)thiophene-2-carboxamide

8018-9606 Screening compound: N-(2-{[3-(5-bromofuran-2-yl)-1,2,4-oxadiazol-5-yl]formamido}ethyl)thiophene-2-carboxamide
8018-9606 Screening compound: N-(2-{[3-(5-bromofuran-2-yl)-1,2,4-oxadiazol-5-yl]formamido}ethyl)thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-9606
N-(2-{[3-(5-bromofuran-2-yl)-1,2,4-oxadiazol-5-yl]formamido}ethyl)thiophene-2-carboxamide

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

8018-9606

Molecular Formula

C14H11BrN4O4S (C14 H11 BrN4 O4 S)

Compound Name

N-(2-{[3-(5-bromofuran-2-yl)-1,2,4-oxadiazol-5-yl]formamido}ethyl)thiophene-2-carboxamide

IUPAC name

N-(2-{[3-(5-bromofuran-2-yl)-124-oxadiazol-5-yl]formamido}ethyl)thiophene-2-carboxamide

SMILES

O=C(c1cccs1)NCCNC(c1nc(-c(o2)ccc2Br)no1)=O

InChI

InChI=1S/C14H11BrN4O4S/c15-10-4-3-8(22-10)11-18-14(23-19-11)13(21)17-6-5-16-12(20)9-2-1-7-24-9/h1-4,7H,5-6H2,(H,16,20)(H,17,21)

InChI Key

SEMRMYISSRSHNF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09063327

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.24

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.699

Distribution Coefficient, logD

1.699

Water Solubility, LogSw

-2.28

Polar Surface Area

90.641

Acid Dissociation Constant (pKa)

13.85

Base Dissociation Constant (pKb)

-0.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

8018-9606 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8018-9606 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-9606?
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What is the minimum amount of 8018-9606 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-9606
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-9606
  • 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 8018-9606 available by request