2900-0514 Screening compound: 4-{5-[2-(4-methoxybenzenesulfonyl)ethyl]-1,3,4-oxadiazol-2-yl}pyridine

2900-0514 Screening compound: 4-{5-[2-(4-methoxybenzenesulfonyl)ethyl]-1,3,4-oxadiazol-2-yl}pyridine
2900-0514 Screening compound: 4-{5-[2-(4-methoxybenzenesulfonyl)ethyl]-1,3,4-oxadiazol-2-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 2900-0514
4-{5-[2-(4-methoxybenzenesulfonyl)ethyl]-1,3,4-oxadiazol-2-yl}pyridine

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

2900-0514

Molecular Formula

C16H15N3O4S (C16 H15 N3 O4 S)

Compound Name

4-{5-[2-(4-methoxybenzenesulfonyl)ethyl]-1,3,4-oxadiazol-2-yl}pyridine

IUPAC name

4-{5-[2-(4-methoxybenzenesulfonyl)ethyl]-134-oxadiazol-2-yl}pyridine

SMILES

COc(cc1)ccc1S(CCc1nnc(-c2ccncc2)o1)(=O)=O

InChI

InChI=1S/C16H15N3O4S/c1-22-13-2-4-14(5-3-13)24(20,21)11-8-15-18-19-16(23-15)12-6-9-17-10-7-12/h2-7,9-10H,8,11H2,1H3

InChI Key

UWVROAGTUWVUEE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01928913

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.38

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.301

Distribution Coefficient, logD

1.300

Water Solubility, LogSw

-2.01

Polar Surface Area

76.156

Acid Dissociation Constant (pKa)

20.92

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

2900-0514 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

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

GPCR Targeted Library (31838 compounds)

Immunological Library (6760 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • GPCR
  • Others
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 2900-0514 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2900-0514?
Check Price and Availability of 2900-0514, 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 2900-0514 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2900-0514
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2900-0514
  • 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 2900-0514 available by request