8001-2623 Screening compound: N-(4-bromo-2,6-dimethylphenyl)-4-tert-butylbenzamide

8001-2623 Screening compound: N-(4-bromo-2,6-dimethylphenyl)-4-tert-butylbenzamide
8001-2623 Screening compound: N-(4-bromo-2,6-dimethylphenyl)-4-tert-butylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8001-2623
N-(4-bromo-2,6-dimethylphenyl)-4-tert-butylbenzamide

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

8001-2623

Molecular Formula

C19H22BrNO (C19 H22 BrNO)

Compound Name

N-(4-bromo-2,6-dimethylphenyl)-4-tert-butylbenzamide

IUPAC name

N-(4-bromo-26-dimethylphenyl)-4-tert-butylbenzamide

SMILES

CC(C)(C)c(cc1)ccc1C(Nc(c(C)c1)c(C)cc1Br)=O

InChI

InChI=1S/C19H22BrNO/c1-12-10-16(20)11-13(2)17(12)21-18(22)14-6-8-15(9-7-14)19(3,4)5/h6-11H,1-5H3,(H,21,22)

InChI Key

UPBAEJVMOLGIJH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00027966

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.29

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.667

Distribution Coefficient, logD

5.651

Water Solubility, LogSw

-5.48

Polar Surface Area

21.934

Acid Dissociation Constant (pKa)

8.84

Base Dissociation Constant (pKb)

-2.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

8001-2623 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 8001-2623 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8001-2623?
Check Price and Availability of 8001-2623, 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 8001-2623 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8001-2623
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8001-2623
  • 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 8001-2623 available by request