D320-0139 Screening compound: ethyl 4-{4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate

D320-0139 Screening compound: ethyl 4-{4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate
D320-0139 Screening compound: ethyl 4-{4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D320-0139
ethyl 4-{4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate

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

D320-0139

Molecular Formula

C20H20N4O4 (C20 H20 N4 O4)

Compound Name

ethyl 4-{4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate

IUPAC name

ethyl 4-{4-[3-(pyridin-3-yl)-124-oxadiazol-5-yl]butanamido}benzoate

SMILES

CCOC(c(cc1)ccc1NC(CCCc1nc(-c2cnccc2)no1)=O)=O

InChI

InChI=1S/C20H20N4O4/c1-2-27-20(26)14-8-10-16(11-9-14)22-17(25)6-3-7-18-23-19(24-28-18)15-5-4-12-21-13-15/h4-5,8-13H,2-3,6-7H2,1H3,(H,22,25)

InChI Key

AJNGJUUEHXBODE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14818875

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.4

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.942

Distribution Coefficient, logD

2.303

Water Solubility, LogSw

-3.15

Polar Surface Area

84.731

Acid Dissociation Constant (pKa)

10.83

Base Dissociation Constant (pKb)

7.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

D320-0139 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • PPI modulators
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with D320-0139 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D320-0139?
Check Price and Availability of D320-0139, 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 D320-0139 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D320-0139
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D320-0139
  • 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 D320-0139 available by request