D245-0458 Screening compound: 3-[5-methyl-7-(4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyridine

D245-0458 Screening compound: 3-[5-methyl-7-(4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyridine
D245-0458 Screening compound: 3-[5-methyl-7-(4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound D245-0458
3-[5-methyl-7-(4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyridine

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

D245-0458

Molecular Formula

C17H20N6 (C17 H20 N6)

Compound Name

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

IUPAC name

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

SMILES

CC(CC1)CCN1c1cc(C)nc2nc(-c3cnccc3)nn12

InChI

InChI=1S/C17H20N6/c1-12-5-8-22(9-6-12)15-10-13(2)19-17-20-16(21-23(15)17)14-4-3-7-18-11-14/h3-4,7,10-12H,5-6,8-9H2,1-2H3

InChI Key

OPCGTVJEMZTFGD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26967387

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.657

Distribution Coefficient, logD

2.272

Water Solubility, LogSw

-2.42

Polar Surface Area

42.635

Acid Dissociation Constant (pKa)

24.11

Base Dissociation Constant (pKb)

7.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

D245-0458 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D245-0458 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D245-0458?
Check Price and Availability of D245-0458, 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 D245-0458 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D245-0458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D245-0458
  • 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 D245-0458 available by request