7775-0048 Screening compound: 5-bromo-1-ethyl-3-hydroxy-2,3-dihydro-1H,1'H-[3,3'-biindol]-2-one

7775-0048 Screening compound: 5-bromo-1-ethyl-3-hydroxy-2,3-dihydro-1H,1'H-[3,3'-biindol]-2-one
7775-0048 Screening compound: 5-bromo-1-ethyl-3-hydroxy-2,3-dihydro-1H,1'H-[3,3'-biindol]-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 7775-0048
5-bromo-1-ethyl-3-hydroxy-2,3-dihydro-1H,1'H-[3,3'-biindol]-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

7775-0048

Molecular Formula

C18H15BrN2O2 (C18 H15 BrN2 O2)

Compound Name

5-bromo-1-ethyl-3-hydroxy-2,3-dihydro-1H,1'H-[3,3'-biindol]-2-one

IUPAC name

5-bromo-1-ethyl-3-hydroxy-23-dihydro-1H1'H-[33'-biindol]-2-one

SMILES

CCN(C(C1(c2c[nH]c3c2cccc3)O)=O)c(cc2)c1cc2Br

InChI

InChI=1S/C18H15BrN2O2/c1-2-21-16-8-7-11(19)9-13(16)18(23,17(21)22)14-10-20-15-6-4-3-5-12(14)15/h3-10,20,23H,2H2,1H3/t18-/m1/s1

InChI Key

DIGOTGCFXABMLN-GOSISDBHSA-N

MDL Number (MFCD)

MFCD02915808

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.23

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.994

Distribution Coefficient, logD

3.994

Water Solubility, LogSw

-4.02

Polar Surface Area

40.196

Acid Dissociation Constant (pKa)

13.80

Base Dissociation Constant (pKb)

-0.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

7775-0048 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 7775-0048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7775-0048?
Check Price and Availability of 7775-0048, 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 7775-0048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7775-0048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7775-0048
  • 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 7775-0048 available by request