D134-0478 Screening compound: ethyl 4-{4-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate

D134-0478 Screening compound: ethyl 4-{4-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate
D134-0478 Screening compound: ethyl 4-{4-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D134-0478
ethyl 4-{4-[3-(4-tert-butylphenyl)-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

D134-0478

Molecular Formula

C25H29N3O4 (C25 H29 N3 O4)

Compound Name

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

IUPAC name

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

SMILES

CCOC(c(cc1)ccc1NC(CCCc1nc(-c2ccc(C(C)(C)C)cc2)no1)=O)=O

InChI

InChI=1S/C25H29N3O4/c1-5-31-24(30)18-11-15-20(16-12-18)26-21(29)7-6-8-22-27-23(28-32-22)17-9-13-19(14-10-17)25(2,3)4/h9-16H,5-8H2,1-4H3,(H,26,29)

InChI Key

AGUFWTFDGVDCAS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08111367

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.217

Distribution Coefficient, logD

6.216

Water Solubility, LogSw

-5.50

Polar Surface Area

75.213

Acid Dissociation Constant (pKa)

10.83

Base Dissociation Constant (pKb)

-1.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

D134-0478 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

SH2 Library (10483 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Endocrine
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • PPI modulators
  • Epigenetic

References: we are preparing a list of scientific research reports with D134-0478 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D134-0478?
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What is the minimum amount of D134-0478 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D134-0478
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D134-0478
  • 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 D134-0478 available by request