S069-1767 Screening compound: [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-1-pyrrolidinyl](1H-indol-5-yl)methanone

S069-1767 Screening compound: [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-1-pyrrolidinyl](1H-indol-5-yl)methanone
S069-1767 Screening compound: [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-1-pyrrolidinyl](1H-indol-5-yl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound S069-1767
[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-1-pyrrolidinyl](1H-indol-5-yl)methanone

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

S069-1767

Molecular Formula

C18H18N4O2 (C18 H18 N4 O2)

Compound Name

[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-1-pyrrolidinyl](1H-indol-5-yl)methanone

IUPAC name

5-[3-(5-cyclopropyl-124-oxadiazol-3-yl)pyrrolidine-1-carbonyl]-1H-indole

SMILES

O=C(c(cc1)cc2c1[nH]cc2)N(CC1)CC1c1noc(C2CC2)n1

InChI

InChI=1S/C18H18N4O2/c23-18(13-3-4-15-12(9-13)5-7-19-15)22-8-6-14(10-22)16-20-17(24-21-16)11-1-2-11/h3-5,7,9,11,14,19H,1-2,6,8,10H2/t14-/m1/s1

InChI Key

AVAHWUJREVEGLQ-CQSZACIVSA-N

MDL Number (MFCD)

MFCD28995497

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.754

Distribution Coefficient, logD

2.754

Water Solubility, LogSw

-3.17

Polar Surface Area

58.896

Acid Dissociation Constant (pKa)

17.05

Base Dissociation Constant (pKb)

-1.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.89

S069-1767 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MEF2-HDAC (class II) Modulators Library (5147 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • Mimetics
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • Epigenetic
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Female
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with S069-1767 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S069-1767?
Check Price and Availability of S069-1767, 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 S069-1767 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S069-1767
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S069-1767
  • 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 S069-1767 available by request