8008-7733 Screening compound: 4-(2,5-dimethylphenoxy)-6-fluoro-2-pyrimidinamine

8008-7733 Screening compound: 4-(2,5-dimethylphenoxy)-6-fluoro-2-pyrimidinamine
8008-7733 Screening compound: 4-(2,5-dimethylphenoxy)-6-fluoro-2-pyrimidinamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-7733
4-(2,5-dimethylphenoxy)-6-fluoro-2-pyrimidinamine

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

8008-7733

Molecular Formula

C12H12FN3O (C12 H12 FN3 O)

Compound Name

4-(2,5-dimethylphenoxy)-6-fluoro-2-pyrimidinamine

IUPAC name

4-(25-dimethylphenoxy)-6-fluoropyrimidin-2-amine

SMILES

Cc1cc(Oc2cc(F)nc(N)n2)c(C)cc1

InChI

InChI=1S/C12H12FN3O/c1-7-3-4-8(2)9(5-7)17-11-6-10(13)15-12(14)16-11/h3-6H,1-2H3,(H2,14,15,16)

InChI Key

JKRIMACKJUDJRN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01346717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

233.25

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.136

Distribution Coefficient, logD

3.136

Water Solubility, LogSw

-3.07

Polar Surface Area

47.892

Acid Dissociation Constant (pKa)

17.63

Base Dissociation Constant (pKb)

0.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

8008-7733 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 8008-7733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-7733?
Check Price and Availability of 8008-7733, 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 8008-7733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-7733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-7733
  • 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 8008-7733 available by request