F070-1178 Screening compound: N-(3-bromophenyl)-4-[3-(trifluoromethyl)quinoxalin-2-yl]piperazine-1-carboxamide

F070-1178 Screening compound: N-(3-bromophenyl)-4-[3-(trifluoromethyl)quinoxalin-2-yl]piperazine-1-carboxamide
F070-1178 Screening compound: N-(3-bromophenyl)-4-[3-(trifluoromethyl)quinoxalin-2-yl]piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F070-1178
N-(3-bromophenyl)-4-[3-(trifluoromethyl)quinoxalin-2-yl]piperazine-1-carboxamide

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

F070-1178

Molecular Formula

C20H17BrF3N5O (C20 H17 BrF3 N5 O)

Compound Name

N-(3-bromophenyl)-4-[3-(trifluoromethyl)quinoxalin-2-yl]piperazine-1-carboxamide

IUPAC name

N-(3-bromophenyl)-4-[3-(trifluoromethyl)quinoxalin-2-yl]piperazine-1-carboxamide

SMILES

O=C(Nc1cccc(Br)c1)N(CC1)CCN1c1nc2ccccc2nc1C(F)(F)F

InChI

InChI=1S/C20H17BrF3N5O/c21-13-4-3-5-14(12-13)25-19(30)29-10-8-28(9-11-29)18-17(20(22,23)24)26-15-6-1-2-7-16(15)27-18/h1-7,12H,8-11H2,(H,25,30)

InChI Key

GTXSIGLBTNKTPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27098687

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.021

Distribution Coefficient, logD

5.021

Water Solubility, LogSw

-4.96

Polar Surface Area

46.604

Acid Dissociation Constant (pKa)

12.15

Base Dissociation Constant (pKb)

3.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

F070-1178 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F070-1178 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F070-1178?
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What is the minimum amount of F070-1178 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F070-1178
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F070-1178
  • 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 F070-1178 available by request