8017-9842 Screening compound: N-(4-amino-6-piperidino-1,3,5-triazin-2-yl)-N-(1,1,1-triphenyl-lambda~5~-phosphanylidene)amine

8017-9842 Screening compound: N-(4-amino-6-piperidino-1,3,5-triazin-2-yl)-N-(1,1,1-triphenyl-lambda~5~-phosphanylidene)amine
8017-9842 Screening compound: N-(4-amino-6-piperidino-1,3,5-triazin-2-yl)-N-(1,1,1-triphenyl-lambda~5~-phosphanylidene)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-9842
N-(4-amino-6-piperidino-1,3,5-triazin-2-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

8017-9842

Molecular Formula

C26H27N6P (C26 H27 N6 P)

Compound Name

N-(4-amino-6-piperidino-1,3,5-triazin-2-yl)-N-(1,1,1-triphenyl-lambda~5~-phosphanylidene)amine

IUPAC name

6-(piperidin-1-yl)-N2-(triphenyl-lambda5-phosphanylidene)-135-triazine-24-diamine

SMILES

Nc1nc(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)nc(N2CCCCC2)n1

InChI

InChI=1S/C26H27N6P/c27-24-28-25(30-26(29-24)32-19-11-4-12-20-32)31-33(21-13-5-1-6-14-21,22-15-7-2-8-16-22)23-17-9-3-10-18-23/h1-3,5-10,13-18H,4,11-12,19-20H2,(H2,27,28,29,30)

InChI Key

HQISJYUTOZBENX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07021650

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.781

Distribution Coefficient, logD

6.781

Water Solubility, LogSw

-6.26

Polar Surface Area

58.895

Acid Dissociation Constant (pKa)

16.69

Base Dissociation Constant (pKb)

2.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.23

8017-9842 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8017-9842 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-9842?
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What is the minimum amount of 8017-9842 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-9842
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-9842
  • 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 8017-9842 available by request