Y020-8518 Screening compound: 2-[6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]propanoic acid

Y020-8518 Screening compound: 2-[6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]propanoic acid
Y020-8518 Screening compound: 2-[6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-8518
2-[6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]propanoic acid

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

Y020-8518

Molecular Formula

C12H10N4O3 (C12 H10 N4 O3)

Compound Name

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

IUPAC name

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

SMILES

CC(C(O)=O)N(C=Cc1c2cnc3ccnn13)C2=O

InChI

InChI=1S/C12H10N4O3/c1-7(12(18)19)15-5-3-9-8(11(15)17)6-13-10-2-4-14-16(9)10/h2-7H,1H3,(H,18,19)/t7-/m0/s1

InChI Key

CEFYRYDUZVXDGU-ZETCQYMHSA-N

MDL Number (MFCD)

MFCD15209237

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

258.24

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.575

Distribution Coefficient, logD

-3.552

Water Solubility, LogSw

-1.33

Polar Surface Area

68.496

Acid Dissociation Constant (pKa)

4.42

Base Dissociation Constant (pKb)

-0.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

Y020-8518 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with Y020-8518 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-8518?
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What is the minimum amount of Y020-8518 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-8518
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-8518
  • 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 Y020-8518 available by request