F509-0458 Screening compound: 2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-cyclohexylacetamide

F509-0458 Screening compound: 2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-cyclohexylacetamide
F509-0458 Screening compound: 2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-cyclohexylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F509-0458
2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-cyclohexylacetamide

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

F509-0458

Molecular Formula

C22H25ClN4O2 (C22 H25 ClN4 O2)

Compound Name

2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-cyclohexylacetamide

IUPAC name

2-[7-(4-chlorophenyl)-56-dimethyl-4-oxo-3H4H7H-pyrrolo[23-d]pyrimidin-3-yl]-N-cyclohexylacetamide

SMILES

Cc(c1c2N=CN(CC(NC3CCCCC3)=O)C1=O)c(C)n2-c(cc1)ccc1Cl

InChI

InChI=1S/C22H25ClN4O2/c1-14-15(2)27(18-10-8-16(23)9-11-18)21-20(14)22(29)26(13-24-21)12-19(28)25-17-6-4-3-5-7-17/h8-11,13,17H,3-7,12H2,1-2H3,(H,25,28)

InChI Key

YUKTYMBVJHOGDQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14957556

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.92

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.773

Distribution Coefficient, logD

3.773

Water Solubility, LogSw

-4.68

Polar Surface Area

52.862

Acid Dissociation Constant (pKa)

15.90

Base Dissociation Constant (pKb)

3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

References: we are preparing a list of scientific research reports with F509-0458 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F509-0458?
Check Price and Availability of F509-0458, 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 F509-0458 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F509-0458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F509-0458
  • 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 F509-0458 available by request