8018-5066 Screening compound: 4-[4-(4-bromobenzenesulfonyl)-2-(furan-2-yl)-1,3-oxazol-5-yl]morpholine

8018-5066 Screening compound: 4-[4-(4-bromobenzenesulfonyl)-2-(furan-2-yl)-1,3-oxazol-5-yl]morpholine
8018-5066 Screening compound: 4-[4-(4-bromobenzenesulfonyl)-2-(furan-2-yl)-1,3-oxazol-5-yl]morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-5066
4-[4-(4-bromobenzenesulfonyl)-2-(furan-2-yl)-1,3-oxazol-5-yl]morpholine

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

8018-5066

Molecular Formula

C17H15BrN2O5S (C17 H15 BrN2 O5 S)

Compound Name

4-[4-(4-bromobenzenesulfonyl)-2-(furan-2-yl)-1,3-oxazol-5-yl]morpholine

IUPAC name

4-[4-(4-bromobenzenesulfonyl)-2-(furan-2-yl)-13-oxazol-5-yl]morpholine

SMILES

O=S(c1c(N2CCOCC2)oc(-c2ccco2)n1)(c(cc1)ccc1Br)=O

InChI

InChI=1S/C17H15BrN2O5S/c18-12-3-5-13(6-4-12)26(21,22)16-17(20-7-10-23-11-8-20)25-15(19-16)14-2-1-9-24-14/h1-6,9H,7-8,10-11H2

InChI Key

WQHYTHSMLCPUAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04591200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.29

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.409

Distribution Coefficient, logD

3.409

Water Solubility, LogSw

-3.56

Polar Surface Area

67.966

Acid Dissociation Constant (pKa)

27.23

Base Dissociation Constant (pKb)

-6.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

8018-5066 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

BRD4 Targeted Library (4534 compounds)

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

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8018-5066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-5066?
Check Price and Availability of 8018-5066, 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 8018-5066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-5066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-5066
  • 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 8018-5066 available by request