8012-7296 Screening compound: N-{2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}-3-bromobenzamide

8012-7296 Screening compound: N-{2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}-3-bromobenzamide
8012-7296 Screening compound: N-{2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}-3-bromobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-7296
N-{2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}-3-bromobenzamide

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

8012-7296

Molecular Formula

C25H23BrN2O2 (C25 H23 BrN2 O2)

Compound Name

N-{2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}-3-bromobenzamide

IUPAC name

N-{2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}-3-bromobenzamide

SMILES

Cc1c(CCNC(c2cccc(Br)c2)=O)c(cc(cc2)OCc3ccccc3)c2[nH]1

InChI

InChI=1S/C25H23BrN2O2/c1-17-22(12-13-27-25(29)19-8-5-9-20(26)14-19)23-15-21(10-11-24(23)28-17)30-16-18-6-3-2-4-7-18/h2-11,14-15,28H,12-13,16H2,1H3,(H,27,29)

InChI Key

ILPWPPGIUHLOBB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03308608

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.614

Distribution Coefficient, logD

5.614

Water Solubility, LogSw

-5.69

Polar Surface Area

41.647

Acid Dissociation Constant (pKa)

12.11

Base Dissociation Constant (pKb)

-2.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

8012-7296 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

MCL1 Targeted Library (12200 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 8012-7296 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-7296?
Check Price and Availability of 8012-7296, 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 8012-7296 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-7296
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-7296
  • 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 8012-7296 available by request