F656-0039 Screening compound: 3-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]-5,6-dimethyl-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one

F656-0039 Screening compound: 3-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]-5,6-dimethyl-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one
F656-0039 Screening compound: 3-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]-5,6-dimethyl-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F656-0039
3-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]-5,6-dimethyl-7-phenyl-3H,4H,7H-pyrrolo[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

F656-0039

Molecular Formula

C25H24N4O2 (C25 H24 N4 O2)

Compound Name

3-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]-5,6-dimethyl-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one

IUPAC name

3-[3-(23-dihydro-1H-indol-1-yl)-3-oxopropyl]-56-dimethyl-7-phenyl-3H4H7H-pyrrolo[23-d]pyrimidin-4-one

SMILES

Cc(c1c2N=CN(CCC(N(CC3)c4c3cccc4)=O)C1=O)c(C)n2-c1ccccc1

InChI

InChI=1S/C25H24N4O2/c1-17-18(2)29(20-9-4-3-5-10-20)24-23(17)25(31)27(16-26-24)14-13-22(30)28-15-12-19-8-6-7-11-21(19)28/h3-11,16H,12-15H2,1-2H3

InChI Key

HGHOKLFWZPUISL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27183037

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.544

Distribution Coefficient, logD

3.544

Water Solubility, LogSw

-3.80

Polar Surface Area

44.067

Acid Dissociation Constant (pKa)

22.10

Base Dissociation Constant (pKb)

-0.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

F656-0039 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

GPCR Targeted Library (31838 compounds)

Targeted Diversity Library (40567 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F656-0039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F656-0039?
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What is the minimum amount of F656-0039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F656-0039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F656-0039
  • 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 F656-0039 available by request