F425-0110 Screening compound: 3-(3-methoxyphenyl)-2-({[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-3H,4H-thieno[3,2-d]pyrimidin-4-one

F425-0110 Screening compound: 3-(3-methoxyphenyl)-2-({[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-3H,4H-thieno[3,2-d]pyrimidin-4-one
F425-0110 Screening compound: 3-(3-methoxyphenyl)-2-({[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-3H,4H-thieno[3,2-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F425-0110
3-(3-methoxyphenyl)-2-({[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-3H,4H-thieno[3,2-d]pyrimidin-4-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

F425-0110

Molecular Formula

C21H15N5O3S2 (C21 H15 N5 O3 S2)

Compound Name

3-(3-methoxyphenyl)-2-({[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-3H,4H-thieno[3,2-d]pyrimidin-4-one

IUPAC name

3-(3-methoxyphenyl)-2-({[3-(pyridin-2-yl)-124-oxadiazol-5-yl]methyl}sulfanyl)-3H4H-thieno[32-d]pyrimidin-4-one

SMILES

COc1cccc(N(C2=O)C(SCc3nc(-c4ncccc4)no3)=Nc3c2scc3)c1

InChI

InChI=1S/C21H15N5O3S2/c1-28-14-6-4-5-13(11-14)26-20(27)18-15(8-10-30-18)23-21(26)31-12-17-24-19(25-29-17)16-7-2-3-9-22-16/h2-11H,12H2,1H3

InChI Key

HGEQMPFDNYTOEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11996396

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.848

Distribution Coefficient, logD

3.848

Water Solubility, LogSw

-4.05

Polar Surface Area

74.112

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

3.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

F425-0110 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Angiogenesis library (14822 compounds)

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Cancer
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F425-0110 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F425-0110?
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What is the minimum amount of F425-0110 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F425-0110
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F425-0110
  • 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 F425-0110 available by request