D245-0477 Screening compound: 5-methyl-2-(pyridin-3-yl)-N-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

D245-0477 Screening compound: 5-methyl-2-(pyridin-3-yl)-N-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
D245-0477 Screening compound: 5-methyl-2-(pyridin-3-yl)-N-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D245-0477
5-methyl-2-(pyridin-3-yl)-N-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-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

D245-0477

Molecular Formula

C18H13F3N6 (C18 H13 F3 N6)

Compound Name

5-methyl-2-(pyridin-3-yl)-N-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

IUPAC name

5-methyl-2-(pyridin-3-yl)-N-[3-(trifluoromethyl)phenyl]-[124]triazolo[15-a]pyrimidin-7-amine

SMILES

Cc1nc2nc(-c3cnccc3)nn2c(Nc2cccc(C(F)(F)F)c2)c1

InChI

InChI=1S/C18H13F3N6/c1-11-8-15(24-14-6-2-5-13(9-14)18(19,20)21)27-17(23-11)25-16(26-27)12-4-3-7-22-10-12/h2-10,24H,1H3

InChI Key

LVNCEVAPHFWGRQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26967392

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.698

Distribution Coefficient, logD

3.555

Water Solubility, LogSw

-3.68

Polar Surface Area

49.358

Acid Dissociation Constant (pKa)

14.87

Base Dissociation Constant (pKb)

6.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

D245-0477 in Drug Discovery

Included in Screening Libraries

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D245-0477 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D245-0477?
Check Price and Availability of D245-0477, 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 D245-0477 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D245-0477
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D245-0477
  • 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 D245-0477 available by request