0606-3743 Screening compound: 5-bromo-N-(4-methylphenyl)furan-2-carboxamide

0606-3743 Screening compound: 5-bromo-N-(4-methylphenyl)furan-2-carboxamide
0606-3743 Screening compound: 5-bromo-N-(4-methylphenyl)furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0606-3743
5-bromo-N-(4-methylphenyl)furan-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

0606-3743

Molecular Formula

C12H10BrNO2 (C12 H10 BrNO2)

Compound Name

5-bromo-N-(4-methylphenyl)furan-2-carboxamide

IUPAC name

5-bromo-N-(4-methylphenyl)furan-2-carboxamide

SMILES

Cc(cc1)ccc1NC(c(o1)ccc1Br)=O

InChI

InChI=1S/C12H10BrNO2/c1-8-2-4-9(5-3-8)14-12(15)10-6-7-11(13)16-10/h2-7H,1H3,(H,14,15)

InChI Key

DLUUBMYYVYDOBP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00454491

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.12

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.582

Distribution Coefficient, logD

3.579

Water Solubility, LogSw

-3.56

Polar Surface Area

32.256

Acid Dissociation Constant (pKa)

9.70

Base Dissociation Constant (pKb)

-0.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

0606-3743 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 0606-3743 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0606-3743?
Check Price and Availability of 0606-3743, 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 0606-3743 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0606-3743
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0606-3743
  • 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 0606-3743 available by request