Y020-8449 Screening compound: 7-[4-(trifluoromethoxy)phenyl]-2-(trifluoromethyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one

Y020-8449 Screening compound: 7-[4-(trifluoromethoxy)phenyl]-2-(trifluoromethyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Y020-8449 Screening compound: 7-[4-(trifluoromethoxy)phenyl]-2-(trifluoromethyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-8449
7-[4-(trifluoromethoxy)phenyl]-2-(trifluoromethyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one

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

Y020-8449

Molecular Formula

C16H7F6N5O2 (C16 H7 F6 N5 O2)

Compound Name

7-[4-(trifluoromethoxy)phenyl]-2-(trifluoromethyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one

IUPAC name

11-[4-(trifluoromethoxy)phenyl]-4-(trifluoromethyl)-235711-pentaazatricyclo[7.4.0.0^{26}]trideca-1(9)35712-pentaen-10-one

SMILES

O=C(c1c(C=C2)n3nc(C(F)(F)F)nc3nc1)N2c(cc1)ccc1OC(F)(F)F

InChI

InChI=1S/C16H7F6N5O2/c17-15(18,19)13-24-14-23-7-10-11(27(14)25-13)5-6-26(12(10)28)8-1-3-9(4-2-8)29-16(20,21)22/h1-7H

InChI Key

GQGFOQFGPLDTAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13872396

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.25

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.355

Distribution Coefficient, logD

3.355

Water Solubility, LogSw

-3.64

Polar Surface Area

56.300

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-0.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with Y020-8449 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-8449?
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What is the minimum amount of Y020-8449 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-8449
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-8449
  • 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 Y020-8449 available by request