3253-3294 Screening compound: 3-(1,2-dihydroacenaphthylen-5-yl)-N'-[(E)-[2-(trifluoromethyl)phenyl]methylidene]-1H-pyrazole-5-carbohydrazide

3253-3294 Screening compound: 3-(1,2-dihydroacenaphthylen-5-yl)-N'-[(E)-[2-(trifluoromethyl)phenyl]methylidene]-1H-pyrazole-5-carbohydrazide
3253-3294 Screening compound: 3-(1,2-dihydroacenaphthylen-5-yl)-N'-[(E)-[2-(trifluoromethyl)phenyl]methylidene]-1H-pyrazole-5-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3253-3294
3-(1,2-dihydroacenaphthylen-5-yl)-N'-[(E)-[2-(trifluoromethyl)phenyl]methylidene]-1H-pyrazole-5-carbohydrazide

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

3253-3294

Molecular Formula

C24H17F3N4O (C24 H17 F3 N4 O)

Compound Name

3-(1,2-dihydroacenaphthylen-5-yl)-N'-[(E)-[2-(trifluoromethyl)phenyl]methylidene]-1H-pyrazole-5-carbohydrazide

IUPAC name

3-(12-dihydroacenaphthylen-5-yl)-N'-[(E)-[2-(trifluoromethyl)phenyl]methylidene]-1H-pyrazole-5-carbohydrazide

SMILES

O=C(c1cc(-c2ccc(CC3)c4c3cccc24)n[nH]1)N/N=C/c1c(C(F)(F)F)cccc1

InChI

InChI=1S/C24H17F3N4O/c25-24(26,27)19-7-2-1-4-16(19)13-28-31-23(32)21-12-20(29-30-21)17-11-10-15-9-8-14-5-3-6-18(17)22(14)15/h1-7,10-13H,8-9H2,(H,29,30)(H,31,32)

InChI Key

FIJYHUVJIGZUMC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01913770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.591

Distribution Coefficient, logD

6.588

Water Solubility, LogSw

-6.59

Polar Surface Area

58.059

Acid Dissociation Constant (pKa)

9.61

Base Dissociation Constant (pKb)

0.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

3253-3294 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3253-3294 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3253-3294?
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What is the minimum amount of 3253-3294 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3253-3294
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3253-3294
  • 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 3253-3294 available by request