8009-5030 Screening compound: 4-{2-chloro-5-[(2,6-dimethylmorpholin-4-yl)sulfonyl]benzenesulfonyl}-2,6-dimethylmorpholine

8009-5030 Screening compound: 4-{2-chloro-5-[(2,6-dimethylmorpholin-4-yl)sulfonyl]benzenesulfonyl}-2,6-dimethylmorpholine
8009-5030 Screening compound: 4-{2-chloro-5-[(2,6-dimethylmorpholin-4-yl)sulfonyl]benzenesulfonyl}-2,6-dimethylmorpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-5030
4-{2-chloro-5-[(2,6-dimethylmorpholin-4-yl)sulfonyl]benzenesulfonyl}-2,6-dimethylmorpholine

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

8009-5030

Molecular Formula

C18H27ClN2O6S2 (C18 H27 ClN2 O6 S2)

Compound Name

4-{2-chloro-5-[(2,6-dimethylmorpholin-4-yl)sulfonyl]benzenesulfonyl}-2,6-dimethylmorpholine

IUPAC name

4-{2-chloro-5-[(26-dimethylmorpholin-4-yl)sulfonyl]benzenesulfonyl}-26-dimethylmorpholine

SMILES

CC(C1)OC(C)CN1S(c(cc1)cc(S(N2CC(C)OC(C)C2)(=O)=O)c1Cl)(=O)=O

InChI

InChI=1S/C18H27ClN2O6S2/c1-12-8-20(9-13(2)26-12)28(22,23)16-5-6-17(19)18(7-16)29(24,25)21-10-14(3)27-15(4)11-21/h5-7,12-15H,8-11H2,1-4H3

InChI Key

KYFIKTBEIFAWKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01821630

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.01

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.884

Distribution Coefficient, logD

1.884

Water Solubility, LogSw

-2.71

Polar Surface Area

77.525

Acid Dissociation Constant (pKa)

26.45

Base Dissociation Constant (pKb)

-7.69

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

66.70

8009-5030 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8009-5030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-5030?
Check Price and Availability of 8009-5030, 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 8009-5030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-5030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-5030
  • 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 8009-5030 available by request