Y020-1640 Screening compound: methyl 2-{[9-(3,5-difluorophenyl)-8-oxo-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazolin-2-yl]sulfanyl}acetate

Y020-1640 Screening compound: methyl 2-{[9-(3,5-difluorophenyl)-8-oxo-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazolin-2-yl]sulfanyl}acetate
Y020-1640 Screening compound: methyl 2-{[9-(3,5-difluorophenyl)-8-oxo-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazolin-2-yl]sulfanyl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-1640
methyl 2-{[9-(3,5-difluorophenyl)-8-oxo-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazolin-2-yl]sulfanyl}acetate

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

Y020-1640

Molecular Formula

C18H16F2N4O3S (C18 H16 F2 N4 O3 S)

Compound Name

methyl 2-{[9-(3,5-difluorophenyl)-8-oxo-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazolin-2-yl]sulfanyl}acetate

IUPAC name

methyl 2-{[9-(35-difluorophenyl)-8-oxo-4H5H6H7H8H9H-[124]triazolo[32-b]quinazolin-2-yl]sulfanyl}acetate

SMILES

COC(CSc1nn(C(c2cc(F)cc(F)c2)C(C(CCC2)=O)=C2N2)c2n1)=O

InChI

InChI=1S/C18H16F2N4O3S/c1-27-14(26)8-28-18-22-17-21-12-3-2-4-13(25)15(12)16(24(17)23-18)9-5-10(19)7-11(20)6-9/h5-7,16H,2-4,8H2,1H3,(H,21,22,23)/t16-/m0/s1

InChI Key

CWZCRTWDOWOZRT-INIZCTEOSA-N

MDL Number (MFCD)

MFCD06593866

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.863

Distribution Coefficient, logD

2.802

Water Solubility, LogSw

-3.32

Polar Surface Area

69.917

Acid Dissociation Constant (pKa)

8.21

Base Dissociation Constant (pKb)

-0.24

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

Y020-1640 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Y020-1640 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-1640?
Check Price and Availability of Y020-1640, 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 Y020-1640 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-1640
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-1640
  • 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 Y020-1640 available by request