D330-0004 Screening compound: 3-[(3-bromophenyl)methyl]-2,3-dihydro-1H-indol-2-one

D330-0004 Screening compound: 3-[(3-bromophenyl)methyl]-2,3-dihydro-1H-indol-2-one
D330-0004 Screening compound: 3-[(3-bromophenyl)methyl]-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D330-0004
3-[(3-bromophenyl)methyl]-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

D330-0004

Molecular Formula

C15H12BrNO (C15 H12 BrNO)

Compound Name

3-[(3-bromophenyl)methyl]-2,3-dihydro-1H-indol-2-one

IUPAC name

3-[(3-bromophenyl)methyl]-23-dihydro-1H-indol-2-one

SMILES

O=C(C1Cc2cccc(Br)c2)Nc2c1cccc2

InChI

InChI=1S/C15H12BrNO/c16-11-5-3-4-10(8-11)9-13-12-6-1-2-7-14(12)17-15(13)18/h1-8,13H,9H2,(H,17,18)/t13-/m0/s1

InChI Key

GXTSSKHXXSPBSC-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD13967371

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.17

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.047

Distribution Coefficient, logD

4.047

Water Solubility, LogSw

-4.31

Polar Surface Area

25.210

Acid Dissociation Constant (pKa)

11.10

Base Dissociation Constant (pKb)

-1.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.30

D330-0004 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

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 D330-0004 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D330-0004?
Check Price and Availability of D330-0004, 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 D330-0004 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D330-0004
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D330-0004
  • 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 D330-0004 available by request