D090-0072 Screening compound: 5-bromo-3-[(dimethylamino)methyl]-1,2-dimethyl-1H,8H-indeno[2,1-b]pyrrol-8-one

D090-0072 Screening compound: 5-bromo-3-[(dimethylamino)methyl]-1,2-dimethyl-1H,8H-indeno[2,1-b]pyrrol-8-one
D090-0072 Screening compound: 5-bromo-3-[(dimethylamino)methyl]-1,2-dimethyl-1H,8H-indeno[2,1-b]pyrrol-8-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D090-0072
5-bromo-3-[(dimethylamino)methyl]-1,2-dimethyl-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

D090-0072

Molecular Formula

C16H17BrN2O (C16 H17 BrN2 O)

Compound Name

5-bromo-3-[(dimethylamino)methyl]-1,2-dimethyl-1H,8H-indeno[2,1-b]pyrrol-8-one

IUPAC name

5-bromo-3-[(dimethylamino)methyl]-12-dimethyl-1H8H-indeno[21-b]pyrrol-8-one

SMILES

Cc1c(CN(C)C)c(-c(cc(cc2)Br)c2C2=O)c2n1C

InChI

InChI=1S/C16H17BrN2O/c1-9-13(8-18(2)3)14-12-7-10(17)5-6-11(12)16(20)15(14)19(9)4/h5-7H,8H2,1-4H3

InChI Key

OYLCUBJGWXJMOR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01719431

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

333.23

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.027

Distribution Coefficient, logD

0.555

Water Solubility, LogSw

-3.28

Polar Surface Area

19.707

Acid Dissociation Constant (pKa)

28.25

Base Dissociation Constant (pKb)

9.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.25

D090-0072 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

DGK Inhibitors Library (10558 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
Targets:
  • Kinases
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D090-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D090-0072?
Check Price and Availability of D090-0072, 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 D090-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D090-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D090-0072
  • 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 D090-0072 available by request