8007-8202 Screening compound: 4-methyl-N'-[(2Z)-1,1,1-trifluoro-4-oxo-4-(thiophen-2-yl)butan-2-ylidene]benzohydrazide

8007-8202 Screening compound: 4-methyl-N'-[(2Z)-1,1,1-trifluoro-4-oxo-4-(thiophen-2-yl)butan-2-ylidene]benzohydrazide
8007-8202 Screening compound: 4-methyl-N'-[(2Z)-1,1,1-trifluoro-4-oxo-4-(thiophen-2-yl)butan-2-ylidene]benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-8202
4-methyl-N'-[(2Z)-1,1,1-trifluoro-4-oxo-4-(thiophen-2-yl)butan-2-ylidene]benzohydrazide

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

8007-8202

Molecular Formula

C16H13F3N2O2S (C16 H13 F3 N2 O2 S)

Compound Name

4-methyl-N'-[(2Z)-1,1,1-trifluoro-4-oxo-4-(thiophen-2-yl)butan-2-ylidene]benzohydrazide

IUPAC name

4-methyl-N'-[(2Z)-111-trifluoro-4-oxo-4-(thiophen-2-yl)butan-2-ylidene]benzohydrazide

SMILES

Cc(cc1)ccc1C(N/N=C(/CC(c1cccs1)=O)\C(F)(F)F)=O

InChI

InChI=1S/C16H13F3N2O2S/c1-10-4-6-11(7-5-10)15(23)21-20-14(16(17,18)19)9-12(22)13-3-2-8-24-13/h2-8H,9H2,1H3,(H,21,23)

InChI Key

GQOKUNOAZLYGSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01239749

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.783

Distribution Coefficient, logD

3.774

Water Solubility, LogSw

-4.03

Polar Surface Area

49.419

Acid Dissociation Constant (pKa)

9.08

Base Dissociation Constant (pKb)

-0.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

8007-8202 in Drug Discovery

Included in Screening Libraries

Human GPCR Annotated Library (5539 compounds)

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 8007-8202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-8202?
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What is the minimum amount of 8007-8202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-8202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-8202
  • 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 8007-8202 available by request