3228-0018 Screening compound: 1-benzyl-5-bromo-2-methyl-1H,8H-indeno[2,1-b]pyrrol-8-one

3228-0018 Screening compound: 1-benzyl-5-bromo-2-methyl-1H,8H-indeno[2,1-b]pyrrol-8-one
3228-0018 Screening compound: 1-benzyl-5-bromo-2-methyl-1H,8H-indeno[2,1-b]pyrrol-8-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3228-0018
1-benzyl-5-bromo-2-methyl-1H,8H-indeno[2,1-b]pyrrol-8-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

3228-0018

Molecular Formula

C19H14BrNO (C19 H14 BrNO)

Compound Name

1-benzyl-5-bromo-2-methyl-1H,8H-indeno[2,1-b]pyrrol-8-one

IUPAC name

n/a

SMILES

Cc1cc(-c(cc(cc2)Br)c2C2=O)c2n1Cc1ccccc1

InChI

InChI=1S/C19H14BrNO/c1-12-9-17-16-10-14(20)7-8-15(16)19(22)18(17)21(12)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3

InChI Key

PQHGRJUSLLMWIR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00588728

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.23

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.160

Distribution Coefficient, logD

5.160

Water Solubility, LogSw

-5.05

Polar Surface Area

14.962

Acid Dissociation Constant (pKa)

26.32

Base Dissociation Constant (pKb)

-5.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

3228-0018 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with 3228-0018 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3228-0018?
Check Price and Availability of 3228-0018, 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 3228-0018 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3228-0018
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3228-0018
  • 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 3228-0018 available by request