G728-0539 Screening compound: 3-[(4-chlorobenzenesulfonyl)methyl]-N-cyclopropyl-1,2,4-oxadiazole-5-carboxamide

G728-0539 Screening compound: 3-[(4-chlorobenzenesulfonyl)methyl]-N-cyclopropyl-1,2,4-oxadiazole-5-carboxamide
G728-0539 Screening compound: 3-[(4-chlorobenzenesulfonyl)methyl]-N-cyclopropyl-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G728-0539
3-[(4-chlorobenzenesulfonyl)methyl]-N-cyclopropyl-1,2,4-oxadiazole-5-carboxamide

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

G728-0539

Molecular Formula

C13H12ClN3O4S (C13 H12 ClN3 O4 S)

Compound Name

3-[(4-chlorobenzenesulfonyl)methyl]-N-cyclopropyl-1,2,4-oxadiazole-5-carboxamide

IUPAC name

3-[(4-chlorobenzenesulfonyl)methyl]-N-cyclopropyl-124-oxadiazole-5-carboxamide

SMILES

O=C(c1nc(CS(c(cc2)ccc2Cl)(=O)=O)no1)NC1CC1

InChI

InChI=1S/C13H12ClN3O4S/c14-8-1-5-10(6-2-8)22(19,20)7-11-16-13(21-17-11)12(18)15-9-3-4-9/h1-2,5-6,9H,3-4,7H2,(H,15,18)

InChI Key

JSRUHFJTVYTYQG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15030185

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.77

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.502

Distribution Coefficient, logD

1.502

Water Solubility, LogSw

-2.81

Polar Surface Area

86.412

Acid Dissociation Constant (pKa)

12.08

Base Dissociation Constant (pKb)

-2.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

G728-0539 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G728-0539 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G728-0539?
Check Price and Availability of G728-0539, 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 G728-0539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G728-0539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G728-0539
  • 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 G728-0539 available by request