2021-0105 Screening compound: N-(4-bromo-2-fluorophenyl)-2,6-dimethoxybenzamide

2021-0105 Screening compound: N-(4-bromo-2-fluorophenyl)-2,6-dimethoxybenzamide
2021-0105 Screening compound: N-(4-bromo-2-fluorophenyl)-2,6-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2021-0105
N-(4-bromo-2-fluorophenyl)-2,6-dimethoxybenzamide

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

2021-0105

Molecular Formula

C15H13BrFNO3 (C15 H13 BrFNO3)

Compound Name

N-(4-bromo-2-fluorophenyl)-2,6-dimethoxybenzamide

IUPAC name

N-(4-bromo-2-fluorophenyl)-26-dimethoxybenzamide

SMILES

COc1cccc(OC)c1C(Nc(ccc(Br)c1)c1F)=O

InChI

InChI=1S/C15H13BrFNO3/c1-20-12-4-3-5-13(21-2)14(12)15(19)18-11-7-6-9(16)8-10(11)17/h3-8H,1-2H3,(H,18,19)

InChI Key

QDYVEVWZPBFLBY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01359602

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.18

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.422

Distribution Coefficient, logD

0.984

Water Solubility, LogSw

-3.93

Polar Surface Area

37.893

Acid Dissociation Constant (pKa)

4.96

Base Dissociation Constant (pKb)

-2.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

2021-0105 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 2021-0105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2021-0105?
Check Price and Availability of 2021-0105, 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 2021-0105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2021-0105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2021-0105
  • 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 2021-0105 available by request