6655-0539 Screening compound: methyl 2-(3-benzoyl-1H-indol-1-yl)acetate

6655-0539 Screening compound: methyl 2-(3-benzoyl-1H-indol-1-yl)acetate
6655-0539 Screening compound: methyl 2-(3-benzoyl-1H-indol-1-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6655-0539
methyl 2-(3-benzoyl-1H-indol-1-yl)acetate

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

6655-0539

Molecular Formula

C18H15NO3 (C18 H15 NO3)

Compound Name

methyl 2-(3-benzoyl-1H-indol-1-yl)acetate

IUPAC name

methyl 2-(3-benzoyl-1H-indol-1-yl)acetate

SMILES

COC(Cn1c(cccc2)c2c(C(c2ccccc2)=O)c1)=O

InChI

InChI=1S/C18H15NO3/c1-22-17(20)12-19-11-15(14-9-5-6-10-16(14)19)18(21)13-7-3-2-4-8-13/h2-11H,12H2,1H3

InChI Key

UNGXSODWOLHWQA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04333908

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.915

Distribution Coefficient, logD

2.915

Water Solubility, LogSw

-3.20

Polar Surface Area

36.288

Acid Dissociation Constant (pKa)

22.13

Base Dissociation Constant (pKb)

-4.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

6655-0539 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 6655-0539 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6655-0539?
Check Price and Availability of 6655-0539, 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 6655-0539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6655-0539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6655-0539
  • 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 6655-0539 available by request