Y021-0401 Screening compound: ethyl 5-propyl-7-(3,4,5-trimethoxyphenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Y021-0401 Screening compound: ethyl 5-propyl-7-(3,4,5-trimethoxyphenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Y021-0401 Screening compound: ethyl 5-propyl-7-(3,4,5-trimethoxyphenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-0401
ethyl 5-propyl-7-(3,4,5-trimethoxyphenyl)-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

Y021-0401

Molecular Formula

C20H26N4O5 (C20 H26 N4 O5)

Compound Name

ethyl 5-propyl-7-(3,4,5-trimethoxyphenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

IUPAC name

ethyl 5-propyl-7-(345-trimethoxyphenyl)-4H7H-[124]triazolo[15-a]pyrimidine-6-carboxylate

SMILES

CCCC(Nc1ncnn1C1c(cc2OC)cc(OC)c2OC)=C1C(OCC)=O

InChI

InChI=1S/C20H26N4O5/c1-6-8-13-16(19(25)29-7-2)17(24-20(23-13)21-11-22-24)12-9-14(26-3)18(28-5)15(10-12)27-4/h9-11,17H,6-8H2,1-5H3,(H,21,22,23)/t17-/m0/s1

InChI Key

JPJPVMNFMJHMAC-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD06193539

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.261

Distribution Coefficient, logD

2.700

Water Solubility, LogSw

-3.36

Polar Surface Area

82.328

Acid Dissociation Constant (pKa)

6.98

Base Dissociation Constant (pKb)

-2.91

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.00

References: we are preparing a list of scientific research reports with Y021-0401 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-0401?
Check Price and Availability of Y021-0401, 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 Y021-0401 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-0401
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-0401
  • 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 Y021-0401 available by request