D508-0176 Screening compound: 5-bromo-N-[(2-chloro-4-fluorophenyl)methyl]-N-(pyridin-2-yl)furan-2-carboxamide

D508-0176 Screening compound: 5-bromo-N-[(2-chloro-4-fluorophenyl)methyl]-N-(pyridin-2-yl)furan-2-carboxamide
D508-0176 Screening compound: 5-bromo-N-[(2-chloro-4-fluorophenyl)methyl]-N-(pyridin-2-yl)furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D508-0176
5-bromo-N-[(2-chloro-4-fluorophenyl)methyl]-N-(pyridin-2-yl)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

D508-0176

Molecular Formula

C17H11BrClFN2O2 (C17 H11 BrClFN2 O2)

Compound Name

5-bromo-N-[(2-chloro-4-fluorophenyl)methyl]-N-(pyridin-2-yl)furan-2-carboxamide

IUPAC name

5-bromo-N-[(2-chloro-4-fluorophenyl)methyl]-N-(pyridin-2-yl)furan-2-carboxamide

SMILES

O=C(c(o1)ccc1Br)N(Cc(ccc(F)c1)c1Cl)c1ncccc1

InChI

InChI=1S/C17H11BrClFN2O2/c18-15-7-6-14(24-15)17(23)22(16-3-1-2-8-21-16)10-11-4-5-12(20)9-13(11)19/h1-9H,10H2

InChI Key

VGBDALUUJCKWNQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18077037

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.64

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.947

Distribution Coefficient, logD

4.947

Water Solubility, LogSw

-5.13

Polar Surface Area

33.027

Acid Dissociation Constant (pKa)

23.04

Base Dissociation Constant (pKb)

2.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

D508-0176 in Drug Discovery

Included in Screening Libraries

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

Antibacterial Compounds Library (13827 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D508-0176 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D508-0176?
Check Price and Availability of D508-0176, 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 D508-0176 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D508-0176
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D508-0176
  • 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 D508-0176 available by request