J057-1107 Screening compound: 4-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzenesulfonyl]thiomorpholine

J057-1107 Screening compound: 4-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzenesulfonyl]thiomorpholine
J057-1107 Screening compound: 4-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzenesulfonyl]thiomorpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound J057-1107
4-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzenesulfonyl]thiomorpholine

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

J057-1107

Molecular Formula

C18H16ClN3O3S2 (C18 H16 ClN3 O3 S2)

Compound Name

4-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzenesulfonyl]thiomorpholine

IUPAC name

4-[4-chloro-3-(5-phenyl-134-oxadiazol-2-yl)benzenesulfonyl]thiomorpholine

SMILES

O=S(c(cc1)cc(-c2nnc(-c3ccccc3)o2)c1Cl)(N1CCSCC1)=O

InChI

InChI=1S/C18H16ClN3O3S2/c19-16-7-6-14(27(23,24)22-8-10-26-11-9-22)12-15(16)18-21-20-17(25-18)13-4-2-1-3-5-13/h1-7,12H,8-11H2

InChI Key

GGLKMFXWXLEJJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27223050

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.93

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.661

Distribution Coefficient, logD

3.661

Water Solubility, LogSw

-4.23

Polar Surface Area

62.193

Acid Dissociation Constant (pKa)

28.41

Base Dissociation Constant (pKb)

-4.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

J057-1107 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with J057-1107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J057-1107?
Check Price and Availability of J057-1107, 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 J057-1107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J057-1107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J057-1107
  • 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 J057-1107 available by request