L957-0075 Screening compound: 2-(pyrrolidine-1-carbonyl)-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole

L957-0075 Screening compound: 2-(pyrrolidine-1-carbonyl)-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole
L957-0075 Screening compound: 2-(pyrrolidine-1-carbonyl)-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound L957-0075
2-(pyrrolidine-1-carbonyl)-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole

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

L957-0075

Molecular Formula

C17H20N4O4S (C17 H20 N4 O4 S)

Compound Name

2-(pyrrolidine-1-carbonyl)-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole

IUPAC name

2-(pyrrolidine-1-carbonyl)-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-134-oxadiazole

SMILES

O=C(c1nnc(-c(cc2)ccc2S(N2CCCC2)(=O)=O)o1)N1CCCC1

InChI

InChI=1S/C17H20N4O4S/c22-17(20-9-1-2-10-20)16-19-18-15(25-16)13-5-7-14(8-6-13)26(23,24)21-11-3-4-12-21/h5-8H,1-4,9-12H2

InChI Key

BWUWOVIUVSKKCJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27489573

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.44

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.534

Distribution Coefficient, logD

1.534

Water Solubility, LogSw

-2.38

Polar Surface Area

79.845

Acid Dissociation Constant (pKa)

27.94

Base Dissociation Constant (pKb)

-3.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.10

L957-0075 in Drug Discovery

Included in Screening Libraries

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

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with L957-0075 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L957-0075?
Check Price and Availability of L957-0075, 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 L957-0075 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L957-0075
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L957-0075
  • 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 L957-0075 available by request