F656-0045 Screening compound: 3-{5,6-dimethyl-4-oxo-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl}-N-(3-phenylpropyl)propanamide

F656-0045 Screening compound: 3-{5,6-dimethyl-4-oxo-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl}-N-(3-phenylpropyl)propanamide
F656-0045 Screening compound: 3-{5,6-dimethyl-4-oxo-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl}-N-(3-phenylpropyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F656-0045
3-{5,6-dimethyl-4-oxo-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl}-N-(3-phenylpropyl)propanamide

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

F656-0045

Molecular Formula

C26H28N4O2 (C26 H28 N4 O2)

Compound Name

3-{5,6-dimethyl-4-oxo-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl}-N-(3-phenylpropyl)propanamide

IUPAC name

3-{56-dimethyl-4-oxo-7-phenyl-3H4H7H-pyrrolo[23-d]pyrimidin-3-yl}-N-(3-phenylpropyl)propanamide

SMILES

Cc(c1c2N=CN(CCC(NCCCc3ccccc3)=O)C1=O)c(C)n2-c1ccccc1

InChI

InChI=1S/C26H28N4O2/c1-19-20(2)30(22-13-7-4-8-14-22)25-24(19)26(32)29(18-28-25)17-15-23(31)27-16-9-12-21-10-5-3-6-11-21/h3-8,10-11,13-14,18H,9,12,15-17H2,1-2H3,(H,27,31)

InChI Key

XNEJGPZQEUFZIX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27183039

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.758

Distribution Coefficient, logD

3.758

Water Solubility, LogSw

-4.20

Polar Surface Area

52.957

Acid Dissociation Constant (pKa)

14.40

Base Dissociation Constant (pKb)

-0.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

F656-0045 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Peptidomimetic Library (37031 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with F656-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F656-0045?
Check Price and Availability of F656-0045, 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 F656-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F656-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F656-0045
  • 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 F656-0045 available by request