R152-0444 Screening compound: 2-bromo-N-(2,5-dimethoxyphenyl)butanamide

R152-0444 Screening compound: 2-bromo-N-(2,5-dimethoxyphenyl)butanamide
R152-0444 Screening compound: 2-bromo-N-(2,5-dimethoxyphenyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound R152-0444
2-bromo-N-(2,5-dimethoxyphenyl)butanamide

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

R152-0444

Molecular Formula

C12H16BrNO3 (C12 H16 BrNO3)

Compound Name

2-bromo-N-(2,5-dimethoxyphenyl)butanamide

IUPAC name

2-bromo-N-(25-dimethoxyphenyl)butanamide

SMILES

CCC(C(Nc(cc(cc1)OC)c1OC)=O)Br

InChI

InChI=1S/C12H16BrNO3/c1-4-9(13)12(15)14-10-7-8(16-2)5-6-11(10)17-3/h5-7,9H,4H2,1-3H3,(H,14,15)/t9-/m0/s1

InChI Key

XUOODXCLIQSWQY-VIFPVBQESA-N

MDL Number (MFCD)

MFCD02939928

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.17

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.022

Distribution Coefficient, logD

2.969

Water Solubility, LogSw

-3.29

Polar Surface Area

38.078

Acid Dissociation Constant (pKa)

8.29

Base Dissociation Constant (pKb)

-0.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

R152-0444 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with R152-0444 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R152-0444?
Check Price and Availability of R152-0444, 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 R152-0444 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R152-0444
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R152-0444
  • 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 R152-0444 available by request