5698-3199 Screening compound: 1-{[4-(2-chlorophenoxy)phenyl]sulfonyl}-4-ethylpiperazine

5698-3199 Screening compound: 1-{[4-(2-chlorophenoxy)phenyl]sulfonyl}-4-ethylpiperazine
5698-3199 Screening compound: 1-{[4-(2-chlorophenoxy)phenyl]sulfonyl}-4-ethylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5698-3199
1-{[4-(2-chlorophenoxy)phenyl]sulfonyl}-4-ethylpiperazine

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

5698-3199

Molecular Formula

C18H21ClN2O3S (C18 H21 ClN2 O3 S)

Compound Name

1-{[4-(2-chlorophenoxy)phenyl]sulfonyl}-4-ethylpiperazine

IUPAC name

1-[4-(2-chlorophenoxy)benzenesulfonyl]-4-ethylpiperazine

SMILES

CCN(CC1)CCN1S(c(cc1)ccc1Oc(cccc1)c1Cl)(=O)=O

InChI

InChI=1S/C18H21ClN2O3S/c1-2-20-11-13-21(14-12-20)25(22,23)16-9-7-15(8-10-16)24-18-6-4-3-5-17(18)19/h3-10H,2,11-14H2,1H3

InChI Key

VTXZSOLDFFNQET-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03619099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.9

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.452

Distribution Coefficient, logD

3.365

Water Solubility, LogSw

-3.78

Polar Surface Area

42.320

Acid Dissociation Constant (pKa)

28.43

Base Dissociation Constant (pKb)

6.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

5698-3199 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with 5698-3199 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5698-3199?
Check Price and Availability of 5698-3199, 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 5698-3199 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5698-3199
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5698-3199
  • 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 5698-3199 available by request