D245-0459 Screening compound: 1-methyl-4-[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazine

D245-0459 Screening compound: 1-methyl-4-[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazine
D245-0459 Screening compound: 1-methyl-4-[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D245-0459
1-methyl-4-[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazine

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

D245-0459

Molecular Formula

C16H19N7 (C16 H19 N7)

Compound Name

1-methyl-4-[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazine

IUPAC name

1-methyl-4-[5-methyl-2-(pyridin-3-yl)-[124]triazolo[15-a]pyrimidin-7-yl]piperazine

SMILES

Cc1nc2nc(-c3cnccc3)nn2c(N2CCN(C)CC2)c1

InChI

InChI=1S/C16H19N7/c1-12-10-14(22-8-6-21(2)7-9-22)23-16(18-12)19-15(20-23)13-4-3-5-17-11-13/h3-5,10-11H,6-9H2,1-2H3

InChI Key

XJDMYABBVKCVOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26967388

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.145

Distribution Coefficient, logD

0.524

Water Solubility, LogSw

-0.41

Polar Surface Area

46.112

Acid Dissociation Constant (pKa)

24.50

Base Dissociation Constant (pKb)

7.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

D245-0459 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Soluble Diversity Library (15920 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D245-0459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D245-0459?
Check Price and Availability of D245-0459, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D245-0459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D245-0459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D245-0459
  • 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 D245-0459 available by request