F160-0439 Screening compound: 3-[(2,5-dimethylphenyl)methyl]-5,6-dimethyl-3H,4H-furo[2,3-d]pyrimidin-4-one

F160-0439 Screening compound: 3-[(2,5-dimethylphenyl)methyl]-5,6-dimethyl-3H,4H-furo[2,3-d]pyrimidin-4-one
F160-0439 Screening compound: 3-[(2,5-dimethylphenyl)methyl]-5,6-dimethyl-3H,4H-furo[2,3-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F160-0439
3-[(2,5-dimethylphenyl)methyl]-5,6-dimethyl-3H,4H-furo[2,3-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

F160-0439

Molecular Formula

C17H18N2O2 (C17 H18 N2 O2)

Compound Name

3-[(2,5-dimethylphenyl)methyl]-5,6-dimethyl-3H,4H-furo[2,3-d]pyrimidin-4-one

IUPAC name

3-[(25-dimethylphenyl)methyl]-56-dimethyl-3H4H-furo[23-d]pyrimidin-4-one

SMILES

Cc1c(C)oc(N=CN2Cc3c(C)ccc(C)c3)c1C2=O

InChI

InChI=1S/C17H18N2O2/c1-10-5-6-11(2)14(7-10)8-19-9-18-16-15(17(19)20)12(3)13(4)21-16/h5-7,9H,8H2,1-4H3

InChI Key

DKSRYNZXQCKFDH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27106047

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.421

Distribution Coefficient, logD

3.421

Water Solubility, LogSw

-3.48

Polar Surface Area

33.721

Acid Dissociation Constant (pKa)

27.89

Base Dissociation Constant (pKb)

1.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

F160-0439 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with F160-0439 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F160-0439?
Check Price and Availability of F160-0439, 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 F160-0439 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F160-0439
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F160-0439
  • 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 F160-0439 available by request