F886-0037 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]furan-2-sulfonamide

F886-0037 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]furan-2-sulfonamide
F886-0037 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]furan-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F886-0037
N-[2-(4-chlorophenyl)ethyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]furan-2-sulfonamide

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

F886-0037

Molecular Formula

C16H12ClF3N2O4S (C16 H12 ClF3 N2 O4 S)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]furan-2-sulfonamide

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-5-[5-(trifluoromethyl)-12-oxazol-3-yl]furan-2-sulfonamide

SMILES

O=S(c1ccc(-c2noc(C(F)(F)F)c2)o1)(NCCc(cc1)ccc1Cl)=O

InChI

InChI=1S/C16H12ClF3N2O4S/c17-11-3-1-10(2-4-11)7-8-21-27(23,24)15-6-5-13(25-15)12-9-14(26-22-12)16(18,19)20/h1-6,9,21H,7-8H2

InChI Key

ZECQEBAUAFNXRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28119704

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.8

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.460

Distribution Coefficient, logD

4.460

Water Solubility, LogSw

-4.62

Polar Surface Area

72.265

Acid Dissociation Constant (pKa)

11.05

Base Dissociation Constant (pKb)

-6.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

F886-0037 in Drug Discovery

Included in Screening Libraries

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

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F886-0037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F886-0037?
Check Price and Availability of F886-0037, 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 F886-0037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F886-0037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F886-0037
  • 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 F886-0037 available by request