8013-2409 Screening compound: N-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-N-(1,1,1-triphenyl-lambda~5~-phosphanylidene)amine

8013-2409 Screening compound: N-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-N-(1,1,1-triphenyl-lambda~5~-phosphanylidene)amine
8013-2409 Screening compound: N-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-N-(1,1,1-triphenyl-lambda~5~-phosphanylidene)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-2409
N-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-N-(1,1,1-triphenyl-lambda~5~-phosphanylidene)amine

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

8013-2409

Molecular Formula

C24H17F3N5P (C24 H17 F3 N5 P)

Compound Name

N-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-N-(1,1,1-triphenyl-lambda~5~-phosphanylidene)amine

IUPAC name

111-triphenyl-N-[3-(trifluoromethyl)-[124]triazolo[43-b]pyridazin-6-yl]-lambda5-phosphanimine

SMILES

FC(c1nnc(cc2)n1nc2N=P(c1ccccc1)(c1ccccc1)c1ccccc1)(F)F

InChI

InChI=1S/C24H17F3N5P/c25-24(26,27)23-29-28-22-17-16-21(30-32(22)23)31-33(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-17H

InChI Key

HNOUWPZEIZIRRW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03763930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.915

Distribution Coefficient, logD

5.915

Water Solubility, LogSw

-6.27

Polar Surface Area

38.046

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

References: we are preparing a list of scientific research reports with 8013-2409 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-2409?
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What is the minimum amount of 8013-2409 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-2409
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-2409
  • 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 8013-2409 available by request