E613-1007 Screening compound: N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetamide

E613-1007 Screening compound: N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetamide
E613-1007 Screening compound: N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E613-1007
N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetamide

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

E613-1007

Molecular Formula

C19H14FN3O4S (C19 H14 FN3 O4 S)

Compound Name

N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetamide

IUPAC name

N-[3-(3-fluorophenyl)-12-oxazol-5-yl]-2-{[5-(thiophen-2-yl)-12-oxazol-3-yl]methoxy}acetamide

SMILES

O=C(COCc1noc(-c2cccs2)c1)Nc1cc(-c2cc(F)ccc2)no1

InChI

InChI=1S/C19H14FN3O4S/c20-13-4-1-3-12(7-13)15-9-19(27-23-15)21-18(24)11-25-10-14-8-16(26-22-14)17-5-2-6-28-17/h1-9H,10-11H2,(H,21,24)

InChI Key

BHJJVQSZBCVJFM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09784222

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.006

Distribution Coefficient, logD

4.006

Water Solubility, LogSw

-4.24

Polar Surface Area

76.880

Acid Dissociation Constant (pKa)

10.40

Base Dissociation Constant (pKb)

-1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

E613-1007 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

GABA Library (7115 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Eye
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • GPCR
  • Ion Channels
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E613-1007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E613-1007?
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What is the minimum amount of E613-1007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E613-1007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E613-1007
  • 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 E613-1007 available by request