E882-1083 Screening compound: 5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}-3,3-dimethyl-2,3-dihydro-1H-indol-2-one

E882-1083 Screening compound: 5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}-3,3-dimethyl-2,3-dihydro-1H-indol-2-one
E882-1083 Screening compound: 5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}-3,3-dimethyl-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E882-1083
5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}-3,3-dimethyl-2,3-dihydro-1H-indol-2-one

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

E882-1083

Molecular Formula

C21H25N3O4S (C21 H25 N3 O4 S)

Compound Name

5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}-3,3-dimethyl-2,3-dihydro-1H-indol-2-one

IUPAC name

5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}-33-dimethyl-23-dihydro-1H-indol-2-one

SMILES

CC(C)(c(cc(cc1)S(N(CC2)CCN2c(cccc2)c2OC)(=O)=O)c1N1)C1=O

InChI

InChI=1S/C21H25N3O4S/c1-21(2)16-14-15(8-9-17(16)22-20(21)25)29(26,27)24-12-10-23(11-13-24)18-6-4-5-7-19(18)28-3/h4-9,14H,10-13H2,1-3H3,(H,22,25)

InChI Key

YIQJPIXCFFWEKW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14925607

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.150

Distribution Coefficient, logD

3.149

Water Solubility, LogSw

-3.66

Polar Surface Area

67.783

Acid Dissociation Constant (pKa)

10.86

Base Dissociation Constant (pKb)

5.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

E882-1083 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with E882-1083 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E882-1083?
Check Price and Availability of E882-1083, 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 E882-1083 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E882-1083
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E882-1083
  • 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 E882-1083 available by request