Y020-1484 Screening compound: 2-methoxyethyl 2-(benzylsulfanyl)-5-methyl-7-(thiophen-2-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Y020-1484 Screening compound: 2-methoxyethyl 2-(benzylsulfanyl)-5-methyl-7-(thiophen-2-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Y020-1484 Screening compound: 2-methoxyethyl 2-(benzylsulfanyl)-5-methyl-7-(thiophen-2-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-1484
2-methoxyethyl 2-(benzylsulfanyl)-5-methyl-7-(thiophen-2-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

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

Y020-1484

Molecular Formula

C21H22N4O3S2 (C21 H22 N4 O3 S2)

Compound Name

2-methoxyethyl 2-(benzylsulfanyl)-5-methyl-7-(thiophen-2-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

IUPAC name

2-methoxyethyl 2-(benzylsulfanyl)-5-methyl-7-(thiophen-2-yl)-4H7H-[124]triazolo[15-a]pyrimidine-6-carboxylate

SMILES

CC(Nc1nc(SCc2ccccc2)nn1C1c2cccs2)=C1C(OCCOC)=O

InChI

InChI=1S/C21H22N4O3S2/c1-14-17(19(26)28-11-10-27-2)18(16-9-6-12-29-16)25-20(22-14)23-21(24-25)30-13-15-7-4-3-5-8-15/h3-9,12,18H,10-11,13H2,1-2H3,(H,22,23,24)/t18-/m0/s1

InChI Key

HPJIGYLAYFTMLK-SFHVURJKSA-N

MDL Number (MFCD)

MFCD06609229

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.316

Distribution Coefficient, logD

3.179

Water Solubility, LogSw

-3.60

Polar Surface Area

65.908

Acid Dissociation Constant (pKa)

7.83

Base Dissociation Constant (pKb)

-2.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

Y020-1484 in Drug Discovery

Included in Screening Libraries

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with Y020-1484 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-1484?
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What is the minimum amount of Y020-1484 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-1484
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-1484
  • 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 Y020-1484 available by request