F313-3448 Screening compound: 2-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-1-isoindolinone

F313-3448 Screening compound: 2-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-1-isoindolinone
F313-3448 Screening compound: 2-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-1-isoindolinone alternative view

Chemical Structure Depiction of ChemDiv screening compound F313-3448
2-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-1-isoindolinone

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

F313-3448

Molecular Formula

C30H21BrN2O3 (C30 H21 BrN2 O3)

Compound Name

2-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-1-isoindolinone

IUPAC name

2-[(2H-13-benzodioxol-5-yl)methyl]-3-[2-(4-bromophenyl)-1H-indol-3-yl]-23-dihydro-1H-isoindol-1-one

SMILES

O=C(c1c2cccc1)N(Cc(cc1)cc3c1OCO3)C2c1c(-c(cc2)ccc2Br)[nH]c2c1cccc2

InChI

InChI=1S/C30H21BrN2O3/c31-20-12-10-19(11-13-20)28-27(23-7-3-4-8-24(23)32-28)29-21-5-1-2-6-22(21)30(34)33(29)16-18-9-14-25-26(15-18)36-17-35-25/h1-15,29,32H,16-17H2/t29-/m0/s1

InChI Key

FMQSUYCMPJEADJ-LJAQVGFWSA-N

MDL Number (MFCD)

MFCD08680268

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.856

Distribution Coefficient, logD

6.856

Water Solubility, LogSw

-6.29

Polar Surface Area

42.981

Acid Dissociation Constant (pKa)

17.39

Base Dissociation Constant (pKb)

-2.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.00

F313-3448 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with F313-3448 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F313-3448?
Check Price and Availability of F313-3448, 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 F313-3448 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F313-3448
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F313-3448
  • 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 F313-3448 available by request