Y020-8527 Screening compound: N~1~-[6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]-2-phenoxyacetamide

Y020-8527 Screening compound: N~1~-[6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]-2-phenoxyacetamide
Y020-8527 Screening compound: N~1~-[6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]-2-phenoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-8527
N~1~-[6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]-2-phenoxyacetamide

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

Y020-8527

Molecular Formula

C17H13N5O3 (C17 H13 N5 O3)

Compound Name

N~1~-[6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]-2-phenoxyacetamide

IUPAC name

N-{10-oxo-23711-tetraazatricyclo[7.4.0.0^{26}]trideca-1(9)35712-pentaen-11-yl}-2-phenoxyacetamide

SMILES

O=C(COc1ccccc1)NN(C=Cc1c2cnc3ccnn13)C2=O

InChI

InChI=1S/C17H13N5O3/c23-16(11-25-12-4-2-1-3-5-12)20-21-9-7-14-13(17(21)24)10-18-15-6-8-19-22(14)15/h1-10H,11H2,(H,20,23)

InChI Key

MBNSIGCONFELPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15195878

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.667

Distribution Coefficient, logD

0.665

Water Solubility, LogSw

-1.62

Polar Surface Area

73.457

Acid Dissociation Constant (pKa)

9.87

Base Dissociation Constant (pKb)

0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

Y020-8527 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y020-8527 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-8527?
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What is the minimum amount of Y020-8527 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-8527
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-8527
  • 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 Y020-8527 available by request