Y020-9353 Screening compound: 3-[3-(4-chlorophenyl)-2-(methoxymethyl)-6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]propanoic acid

Y020-9353 Screening compound: 3-[3-(4-chlorophenyl)-2-(methoxymethyl)-6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]propanoic acid
Y020-9353 Screening compound: 3-[3-(4-chlorophenyl)-2-(methoxymethyl)-6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-9353
3-[3-(4-chlorophenyl)-2-(methoxymethyl)-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

Y020-9353

Molecular Formula

C20H17ClN4O4 (C20 H17 ClN4 O4)

Compound Name

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

IUPAC name

3-[5-(4-chlorophenyl)-4-(methoxymethyl)-10-oxo-23711-tetraazatricyclo[7.4.0.0^{26}]trideca-1(9)35712-pentaen-11-yl]propanoic acid

SMILES

COCc(c(-c(cc1)ccc1Cl)c1nc2)nn1c(C=CN1CCC(O)=O)c2C1=O

InChI

InChI=1S/C20H17ClN4O4/c1-29-11-15-18(12-2-4-13(21)5-3-12)19-22-10-14-16(25(19)23-15)6-8-24(20(14)28)9-7-17(26)27/h2-6,8,10H,7,9,11H2,1H3,(H,26,27)

InChI Key

RTLSBJRKFNVXRO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15198021

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.83

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.375

Distribution Coefficient, logD

-1.158

Water Solubility, LogSw

-2.74

Polar Surface Area

75.751

Acid Dissociation Constant (pKa)

4.87

Base Dissociation Constant (pKb)

-0.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

Y020-9353 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y020-9353 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-9353?
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What is the minimum amount of Y020-9353 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-9353
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-9353
  • 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 Y020-9353 available by request