Y020-1638 Screening compound: 9-(3,5-difluorophenyl)-2-methyl-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazolin-8-one

Y020-1638 Screening compound: 9-(3,5-difluorophenyl)-2-methyl-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazolin-8-one
Y020-1638 Screening compound: 9-(3,5-difluorophenyl)-2-methyl-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazolin-8-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-1638
9-(3,5-difluorophenyl)-2-methyl-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazolin-8-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

Y020-1638

Molecular Formula

C16H14F2N4O (C16 H14 F2 N4 O)

Compound Name

9-(3,5-difluorophenyl)-2-methyl-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazolin-8-one

IUPAC name

9-(35-difluorophenyl)-2-methyl-4H5H6H7H8H9H-[124]triazolo[32-b]quinazolin-8-one

SMILES

Cc1nn(C(c2cc(F)cc(F)c2)C(C(CCC2)=O)=C2N2)c2n1

InChI

InChI=1S/C16H14F2N4O/c1-8-19-16-20-12-3-2-4-13(23)14(12)15(22(16)21-8)9-5-10(17)7-11(18)6-9/h5-7,15H,2-4H2,1H3,(H,19,20,21)/t15-/m0/s1

InChI Key

GYJISTGIVNUIHE-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD06613178

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.31

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.556

Distribution Coefficient, logD

1.676

Water Solubility, LogSw

-2.71

Polar Surface Area

50.229

Acid Dissociation Constant (pKa)

6.58

Base Dissociation Constant (pKb)

-0.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.30

Y020-1638 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with Y020-1638 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-1638?
Check Price and Availability of Y020-1638, 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 Y020-1638 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-1638
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-1638
  • 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 Y020-1638 available by request