D330-0080 Screening compound: 3-[(5-bromo-2,3-dimethoxyphenyl)methyl]-2,3-dihydro-1H-indol-2-one

D330-0080 Screening compound: 3-[(5-bromo-2,3-dimethoxyphenyl)methyl]-2,3-dihydro-1H-indol-2-one
D330-0080 Screening compound: 3-[(5-bromo-2,3-dimethoxyphenyl)methyl]-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D330-0080
3-[(5-bromo-2,3-dimethoxyphenyl)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

D330-0080

Molecular Formula

C17H16BrNO3 (C17 H16 BrNO3)

Compound Name

3-[(5-bromo-2,3-dimethoxyphenyl)methyl]-2,3-dihydro-1H-indol-2-one

IUPAC name

3-[(5-bromo-23-dimethoxyphenyl)methyl]-23-dihydro-1H-indol-2-one

SMILES

COc(cc(cc1CC(c(cccc2)c2N2)C2=O)Br)c1OC

InChI

InChI=1S/C17H16BrNO3/c1-21-15-9-11(18)7-10(16(15)22-2)8-13-12-5-3-4-6-14(12)19-17(13)20/h3-7,9,13H,8H2,1-2H3,(H,19,20)/t13-/m0/s1

InChI Key

NMAFOXDBGKCEBV-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD13967383

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.22

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.873

Distribution Coefficient, logD

3.873

Water Solubility, LogSw

-4.08

Polar Surface Area

40.558

Acid Dissociation Constant (pKa)

11.10

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.50

D330-0080 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D330-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D330-0080?
Check Price and Availability of D330-0080, 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 D330-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D330-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D330-0080
  • 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 D330-0080 available by request