4896-4468 Screening compound: 1-ethyl-3,3-bis(4-hydroxy-3-methoxyphenyl)-2,3-dihydro-1H-indol-2-one

4896-4468 Screening compound: 1-ethyl-3,3-bis(4-hydroxy-3-methoxyphenyl)-2,3-dihydro-1H-indol-2-one
4896-4468 Screening compound: 1-ethyl-3,3-bis(4-hydroxy-3-methoxyphenyl)-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4896-4468
1-ethyl-3,3-bis(4-hydroxy-3-methoxyphenyl)-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

4896-4468

Molecular Formula

C24H23NO5 (C24 H23 NO5)

Compound Name

1-ethyl-3,3-bis(4-hydroxy-3-methoxyphenyl)-2,3-dihydro-1H-indol-2-one

IUPAC name

1-ethyl-33-bis(4-hydroxy-3-methoxyphenyl)-23-dihydro-1H-indol-2-one

SMILES

CCN(C(C1(c(cc2)cc(OC)c2O)c(cc2)cc(OC)c2O)=O)c2c1cccc2

InChI

InChI=1S/C24H23NO5/c1-4-25-18-8-6-5-7-17(18)24(23(25)28,15-9-11-19(26)21(13-15)29-2)16-10-12-20(27)22(14-16)30-3/h5-14,26-27H,4H2,1-3H3

InChI Key

UVJKZISWMSNDFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02371216

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.597

Distribution Coefficient, logD

3.592

Water Solubility, LogSw

-3.43

Polar Surface Area

63.517

Acid Dissociation Constant (pKa)

9.41

Base Dissociation Constant (pKb)

0.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

4896-4468 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Cancer
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands
  • PPI modulators

References: we are preparing a list of scientific research reports with 4896-4468 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4896-4468?
Check Price and Availability of 4896-4468, 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 4896-4468 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4896-4468
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4896-4468
  • 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 4896-4468 available by request