0090-0041 Screening compound: 4-{2-chloro-5-[3-(morpholine-4-sulfonyl)benzenesulfonyl]benzenesulfonyl}morpholine

0090-0041 Screening compound: 4-{2-chloro-5-[3-(morpholine-4-sulfonyl)benzenesulfonyl]benzenesulfonyl}morpholine
0090-0041 Screening compound: 4-{2-chloro-5-[3-(morpholine-4-sulfonyl)benzenesulfonyl]benzenesulfonyl}morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0090-0041
4-{2-chloro-5-[3-(morpholine-4-sulfonyl)benzenesulfonyl]benzenesulfonyl}morpholine

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

0090-0041

Molecular Formula

C20H23ClN2O8S3 (C20 H23 ClN2 O8 S3)

Compound Name

4-{2-chloro-5-[3-(morpholine-4-sulfonyl)benzenesulfonyl]benzenesulfonyl}morpholine

IUPAC name

4-{2-chloro-5-[3-(morpholine-4-sulfonyl)benzenesulfonyl]benzenesulfonyl}morpholine

SMILES

O=S(c1cc(S(N2CCOCC2)(=O)=O)ccc1)(c(cc1)cc(S(N2CCOCC2)(=O)=O)c1Cl)=O

InChI

InChI=1S/C20H23ClN2O8S3/c21-19-5-4-17(15-20(19)34(28,29)23-8-12-31-13-9-23)32(24,25)16-2-1-3-18(14-16)33(26,27)22-6-10-30-11-7-22/h1-5,14-15H,6-13H2

InChI Key

WJYGBPTUXKJMBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00316900

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

551.06

Hydrogen Bond Acceptors Count

16.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.840

Distribution Coefficient, logD

1.840

Water Solubility, LogSw

-2.81

Polar Surface Area

108.978

Acid Dissociation Constant (pKa)

28.41

Base Dissociation Constant (pKb)

-7.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

0090-0041 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 0090-0041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0090-0041?
Check Price and Availability of 0090-0041, 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 0090-0041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0090-0041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0090-0041
  • 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 0090-0041 available by request