Y501-2584 Screening compound: [7-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](2-thienyl)methanone

Y501-2584 Screening compound: [7-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](2-thienyl)methanone
Y501-2584 Screening compound: [7-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](2-thienyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y501-2584
[7-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](2-thienyl)methanone

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

Y501-2584

Molecular Formula

C17H15F3N6OS (C17 H15 F3 N6 OS)

Compound Name

[7-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](2-thienyl)methanone

IUPAC name

1-ethyl-3-methyl-4-[6-(thiophene-2-carbonyl)-5-(trifluoromethyl)-4H7H-[124]triazolo[15-a]pyrimidin-7-yl]-1H-pyrazole

SMILES

CCn1nc(C)c(C2n3ncnc3NC(C(F)(F)F)=C2C(c2cccs2)=O)c1

InChI

InChI=1S/C17H15F3N6OS/c1-3-25-7-10(9(2)24-25)13-12(14(27)11-5-4-6-28-11)15(17(18,19)20)23-16-21-8-22-26(13)16/h4-8,13H,3H2,1-2H3,(H,21,22,23)/t13-/m0/s1

InChI Key

BMEVEZVIWRAICK-ZDUSSCGKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.707

Distribution Coefficient, logD

0.706

Water Solubility, LogSw

-2.96

Polar Surface Area

67.831

Acid Dissociation Constant (pKa)

5.40

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.41

References: we are preparing a list of scientific research reports with Y501-2584 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-2584?
Check Price and Availability of Y501-2584, 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 Y501-2584 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-2584
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-2584
  • 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 Y501-2584 available by request