Y021-0252 Screening compound: 6-ethyl-7-methyl-2-(pyrrolidin-1-yl)-4H,5H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one

Y021-0252 Screening compound: 6-ethyl-7-methyl-2-(pyrrolidin-1-yl)-4H,5H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
Y021-0252 Screening compound: 6-ethyl-7-methyl-2-(pyrrolidin-1-yl)-4H,5H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-0252
6-ethyl-7-methyl-2-(pyrrolidin-1-yl)-4H,5H-[1,2,4]triazolo[1,5-a]pyrimidin-5-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

Y021-0252

Molecular Formula

C12H17N5O (C12 H17 N5 O)

Compound Name

6-ethyl-7-methyl-2-(pyrrolidin-1-yl)-4H,5H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one

IUPAC name

6-ethyl-7-methyl-2-(pyrrolidin-1-yl)-4H5H-[124]triazolo[15-a]pyrimidin-5-one

SMILES

CCC1=C(C)n2nc(N3CCCC3)nc2NC1=O

InChI

InChI=1S/C12H17N5O/c1-3-9-8(2)17-11(13-10(9)18)14-12(15-17)16-6-4-5-7-16/h3-7H2,1-2H3,(H,13,14,15,18)

InChI Key

MAVVREVUMQJREL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27936943

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

247.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.851

Distribution Coefficient, logD

1.850

Water Solubility, LogSw

-2.39

Polar Surface Area

53.856

Acid Dissociation Constant (pKa)

10.00

Base Dissociation Constant (pKb)

-1.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.33

Y021-0252 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with Y021-0252 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-0252?
Check Price and Availability of Y021-0252, 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 Y021-0252 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-0252
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-0252
  • 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 Y021-0252 available by request