L829-0380 Screening compound: 3-[3-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-5-(3-methylthiophen-2-yl)-1,2,4-oxadiazole

L829-0380 Screening compound: 3-[3-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-5-(3-methylthiophen-2-yl)-1,2,4-oxadiazole
L829-0380 Screening compound: 3-[3-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-5-(3-methylthiophen-2-yl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound L829-0380
3-[3-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-5-(3-methylthiophen-2-yl)-1,2,4-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

L829-0380

Molecular Formula

C19H15N3OS2 (C19 H15 N3 OS2)

Compound Name

3-[3-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-5-(3-methylthiophen-2-yl)-1,2,4-oxadiazole

IUPAC name

3-[3-(2-cyclopropyl-13-thiazol-4-yl)phenyl]-5-(3-methylthiophen-2-yl)-124-oxadiazole

SMILES

Cc1c(-c2nc(-c3cccc(-c4csc(C5CC5)n4)c3)no2)scc1

InChI

InChI=1S/C19H15N3OS2/c1-11-7-8-24-16(11)18-21-17(22-23-18)14-4-2-3-13(9-14)15-10-25-19(20-15)12-5-6-12/h2-4,7-10,12H,5-6H2,1H3

InChI Key

XMZBWCDNDXRANK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27478723

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.065

Distribution Coefficient, logD

6.065

Water Solubility, LogSw

-5.72

Polar Surface Area

42.648

Acid Dissociation Constant (pKa)

23.73

Base Dissociation Constant (pKb)

4.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

L829-0380 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with L829-0380 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L829-0380?
Check Price and Availability of L829-0380, 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 L829-0380 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L829-0380
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L829-0380
  • 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 L829-0380 available by request