8018-0742 Screening compound: 4-[2-({[5-chloro-2-(2-morpholino-2-oxoethoxy)phenyl]sulfonyl}amino)ethoxy]benzoic acid

8018-0742 Screening compound: 4-[2-({[5-chloro-2-(2-morpholino-2-oxoethoxy)phenyl]sulfonyl}amino)ethoxy]benzoic acid
8018-0742 Screening compound: 4-[2-({[5-chloro-2-(2-morpholino-2-oxoethoxy)phenyl]sulfonyl}amino)ethoxy]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-0742
4-[2-({[5-chloro-2-(2-morpholino-2-oxoethoxy)phenyl]sulfonyl}amino)ethoxy]benzoic acid

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

8018-0742

Molecular Formula

C21H23ClN2O8S (C21 H23 ClN2 O8 S)

Compound Name

4-[2-({[5-chloro-2-(2-morpholino-2-oxoethoxy)phenyl]sulfonyl}amino)ethoxy]benzoic acid

IUPAC name

4-(2-{5-chloro-2-[2-(morpholin-4-yl)-2-oxoethoxy]benzenesulfonamido}ethoxy)benzoic acid

SMILES

OC(c(cc1)ccc1OCCNS(c(cc(cc1)Cl)c1OCC(N1CCOCC1)=O)(=O)=O)=O

InChI

InChI=1S/C21H23ClN2O8S/c22-16-3-6-18(32-14-20(25)24-8-11-30-12-9-24)19(13-16)33(28,29)23-7-10-31-17-4-1-15(2-5-17)21(26)27/h1-6,13,23H,7-12,14H2,(H,26,27)

InChI Key

XRKDBRHAXGQPID-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07022346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.94

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.051

Distribution Coefficient, logD

-0.467

Water Solubility, LogSw

-2.96

Polar Surface Area

109.279

Acid Dissociation Constant (pKa)

4.88

Base Dissociation Constant (pKb)

-1.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

8018-0742 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8018-0742 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-0742?
Check Price and Availability of 8018-0742, 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 8018-0742 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-0742
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-0742
  • 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 8018-0742 available by request