5926-0072 Screening compound: 3-(6-methyl-1-oxo-2,3,4,9-tetrahydro-1H-carbazol-9-yl)propanoic acid

5926-0072 Screening compound: 3-(6-methyl-1-oxo-2,3,4,9-tetrahydro-1H-carbazol-9-yl)propanoic acid
5926-0072 Screening compound: 3-(6-methyl-1-oxo-2,3,4,9-tetrahydro-1H-carbazol-9-yl)propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 5926-0072
3-(6-methyl-1-oxo-2,3,4,9-tetrahydro-1H-carbazol-9-yl)propanoic acid

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

5926-0072

Molecular Formula

C16H17NO3 (C16 H17 NO3)

Compound Name

3-(6-methyl-1-oxo-2,3,4,9-tetrahydro-1H-carbazol-9-yl)propanoic acid

IUPAC name

3-(6-methyl-1-oxo-2349-tetrahydro-1H-carbazol-9-yl)propanoic acid

SMILES

Cc(cc1)cc2c1n(CCC(O)=O)c1c2CCCC1=O

InChI

InChI=1S/C16H17NO3/c1-10-5-6-13-12(9-10)11-3-2-4-14(18)16(11)17(13)8-7-15(19)20/h5-6,9H,2-4,7-8H2,1H3,(H,19,20)

InChI Key

SWIWTDIKKNWYEX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03624170

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

271.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.383

Distribution Coefficient, logD

-0.411

Water Solubility, LogSw

-2.34

Polar Surface Area

42.882

Acid Dissociation Constant (pKa)

4.61

Base Dissociation Constant (pKb)

-2.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

5926-0072 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 5926-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5926-0072?
Check Price and Availability of 5926-0072, 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 5926-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5926-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5926-0072
  • 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 5926-0072 available by request