M375-0119 Screening compound: 3-{3-[2-(benzenesulfonyl)ethyl]-1,2,4-oxadiazol-5-yl}-1-methyl-1H-indazole

M375-0119 Screening compound: 3-{3-[2-(benzenesulfonyl)ethyl]-1,2,4-oxadiazol-5-yl}-1-methyl-1H-indazole
M375-0119 Screening compound: 3-{3-[2-(benzenesulfonyl)ethyl]-1,2,4-oxadiazol-5-yl}-1-methyl-1H-indazole alternative view

Chemical Structure Depiction of ChemDiv screening compound M375-0119
3-{3-[2-(benzenesulfonyl)ethyl]-1,2,4-oxadiazol-5-yl}-1-methyl-1H-indazole

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

M375-0119

Molecular Formula

C18H16N4O3S (C18 H16 N4 O3 S)

Compound Name

3-{3-[2-(benzenesulfonyl)ethyl]-1,2,4-oxadiazol-5-yl}-1-methyl-1H-indazole

IUPAC name

3-{3-[2-(benzenesulfonyl)ethyl]-124-oxadiazol-5-yl}-1-methyl-1H-indazole

SMILES

Cn(c1c2cccc1)nc2-c1nc(CCS(c2ccccc2)(=O)=O)no1

InChI

InChI=1S/C18H16N4O3S/c1-22-15-10-6-5-9-14(15)17(20-22)18-19-16(21-25-18)11-12-26(23,24)13-7-3-2-4-8-13/h2-10H,11-12H2,1H3

InChI Key

POXASUXCUOWRQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27539353

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.232

Distribution Coefficient, logD

2.232

Water Solubility, LogSw

-2.53

Polar Surface Area

76.207

Acid Dissociation Constant (pKa)

20.92

Base Dissociation Constant (pKb)

-1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

M375-0119 in Drug Discovery

Included in Screening Libraries

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

Immunological Library (6760 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others
Agro:
  • Agro

References: we are preparing a list of scientific research reports with M375-0119 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M375-0119?
Check Price and Availability of M375-0119, 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 M375-0119 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M375-0119
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M375-0119
  • 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 M375-0119 available by request