E882-1090 Screening compound: 3,3-dimethyl-5-[(4-phenylpiperazin-1-yl)sulfonyl]-2,3-dihydro-1H-indol-2-one

E882-1090 Screening compound: 3,3-dimethyl-5-[(4-phenylpiperazin-1-yl)sulfonyl]-2,3-dihydro-1H-indol-2-one
E882-1090 Screening compound: 3,3-dimethyl-5-[(4-phenylpiperazin-1-yl)sulfonyl]-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E882-1090
3,3-dimethyl-5-[(4-phenylpiperazin-1-yl)sulfonyl]-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

E882-1090

Molecular Formula

C20H23N3O3S (C20 H23 N3 O3 S)

Compound Name

3,3-dimethyl-5-[(4-phenylpiperazin-1-yl)sulfonyl]-2,3-dihydro-1H-indol-2-one

IUPAC name

33-dimethyl-5-[(4-phenylpiperazin-1-yl)sulfonyl]-23-dihydro-1H-indol-2-one

SMILES

CC(C)(c(cc(cc1)S(N(CC2)CCN2c2ccccc2)(=O)=O)c1N1)C1=O

InChI

InChI=1S/C20H23N3O3S/c1-20(2)17-14-16(8-9-18(17)21-19(20)24)27(25,26)23-12-10-22(11-13-23)15-6-4-3-5-7-15/h3-9,14H,10-13H2,1-2H3,(H,21,24)

InChI Key

OGYGJRKIAMZQJF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14925611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.149

Distribution Coefficient, logD

3.149

Water Solubility, LogSw

-3.58

Polar Surface Area

60.453

Acid Dissociation Constant (pKa)

10.86

Base Dissociation Constant (pKb)

2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

E882-1090 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E882-1090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E882-1090?
Check Price and Availability of E882-1090, 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 E882-1090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E882-1090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E882-1090
  • 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 E882-1090 available by request