0242-1236 Screening compound: N-(2-benzoyl-4-bromophenyl)-3,4,5-trimethoxybenzamide

0242-1236 Screening compound: N-(2-benzoyl-4-bromophenyl)-3,4,5-trimethoxybenzamide
0242-1236 Screening compound: N-(2-benzoyl-4-bromophenyl)-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0242-1236
N-(2-benzoyl-4-bromophenyl)-3,4,5-trimethoxybenzamide

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

0242-1236

Molecular Formula

C23H20BrNO5 (C23 H20 BrNO5)

Compound Name

N-(2-benzoyl-4-bromophenyl)-3,4,5-trimethoxybenzamide

IUPAC name

N-(2-benzoyl-4-bromophenyl)-345-trimethoxybenzamide

SMILES

COc1cc(C(Nc(ccc(Br)c2)c2C(c2ccccc2)=O)=O)cc(OC)c1OC

InChI

InChI=1S/C23H20BrNO5/c1-28-19-11-15(12-20(29-2)22(19)30-3)23(27)25-18-10-9-16(24)13-17(18)21(26)14-7-5-4-6-8-14/h4-13H,1-3H3,(H,25,27)

InChI Key

XEEBLMIHTZOFEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00336650

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.801

Distribution Coefficient, logD

4.796

Water Solubility, LogSw

-4.64

Polar Surface Area

59.077

Acid Dissociation Constant (pKa)

9.32

Base Dissociation Constant (pKb)

-5.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

0242-1236 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0242-1236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0242-1236?
Check Price and Availability of 0242-1236, 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 0242-1236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0242-1236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0242-1236
  • 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 0242-1236 available by request