L829-0110 Screening compound: 3-(2-{3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}ethyl)-1H-indole

L829-0110 Screening compound: 3-(2-{3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}ethyl)-1H-indole
L829-0110 Screening compound: 3-(2-{3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}ethyl)-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound L829-0110
3-(2-{3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}ethyl)-1H-indole

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

L829-0110

Molecular Formula

C22H18N4OS (C22 H18 N4 OS)

Compound Name

3-(2-{3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}ethyl)-1H-indole

IUPAC name

3-(2-{3-[3-(2-methyl-13-thiazol-4-yl)phenyl]-124-oxadiazol-5-yl}ethyl)-1H-indole

SMILES

Cc1nc(-c2cc(-c3noc(CCc4c[nH]c5c4cccc5)n3)ccc2)cs1

InChI

InChI=1S/C22H18N4OS/c1-14-24-20(13-28-14)15-5-4-6-16(11-15)22-25-21(27-26-22)10-9-17-12-23-19-8-3-2-7-18(17)19/h2-8,11-13,23H,9-10H2,1H3

InChI Key

NOMWXTFFLNERIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27478631

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.989

Distribution Coefficient, logD

5.989

Water Solubility, LogSw

-5.95

Polar Surface Area

50.721

Acid Dissociation Constant (pKa)

17.92

Base Dissociation Constant (pKb)

2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

L829-0110 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anti-Inflammatory Library (24602 compounds)

Indole Derivatives (10091 compounds)

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L829-0110 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L829-0110?
Check Price and Availability of L829-0110, 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 L829-0110 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L829-0110
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L829-0110
  • 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 L829-0110 available by request