3606-0222 Screening compound: 6-bromo-9-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one

3606-0222 Screening compound: 6-bromo-9-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one
3606-0222 Screening compound: 6-bromo-9-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3606-0222
6-bromo-9-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-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

3606-0222

Molecular Formula

C13H12BrNO (C13 H12 BrNO)

Compound Name

6-bromo-9-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one

IUPAC name

6-bromo-9-methyl-2349-tetrahydro-1H-carbazol-1-one

SMILES

Cn1c(C(CCC2)=O)c2c2c1ccc(Br)c2

InChI

InChI=1S/C13H12BrNO/c1-15-11-6-5-8(14)7-10(11)9-3-2-4-12(16)13(9)15/h5-7H,2-4H2,1H3

InChI Key

SKCOAJQVJZTOEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00459405

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

278.15

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.474

Distribution Coefficient, logD

3.474

Water Solubility, LogSw

-3.88

Polar Surface Area

15.330

Acid Dissociation Constant (pKa)

17.27

Base Dissociation Constant (pKb)

-2.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

3606-0222 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 3606-0222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3606-0222?
Check Price and Availability of 3606-0222, 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 3606-0222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3606-0222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3606-0222
  • 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 3606-0222 available by request