F228-0840 Screening compound: N-[(3-bromophenyl)methyl]-1-{2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl}piperidine-4-carboxamide

F228-0840 Screening compound: N-[(3-bromophenyl)methyl]-1-{2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl}piperidine-4-carboxamide
F228-0840 Screening compound: N-[(3-bromophenyl)methyl]-1-{2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F228-0840
N-[(3-bromophenyl)methyl]-1-{2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl}piperidine-4-carboxamide

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

F228-0840

Molecular Formula

C22H25BrN4O2 (C22 H25 BrN4 O2)

Compound Name

N-[(3-bromophenyl)methyl]-1-{2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl}piperidine-4-carboxamide

IUPAC name

N-[(3-bromophenyl)methyl]-1-{256-trimethylfuro[23-d]pyrimidin-4-yl}piperidine-4-carboxamide

SMILES

Cc1c(C)oc2c1c(N(CC1)CCC1C(NCc1cccc(Br)c1)=O)nc(C)n2

InChI

InChI=1S/C22H25BrN4O2/c1-13-14(2)29-22-19(13)20(25-15(3)26-22)27-9-7-17(8-10-27)21(28)24-12-16-5-4-6-18(23)11-16/h4-6,11,17H,7-10,12H2,1-3H3,(H,24,28)

InChI Key

PMECYOLNGWQYFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14945671

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.37

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

4.076

Distribution Coefficient, logD

3.739

Water Solubility, LogSw

-4.32

Polar Surface Area

54.342

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

7.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

F228-0840 in Drug Discovery

Included in Screening Libraries

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with F228-0840 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F228-0840?
Check Price and Availability of F228-0840, 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 F228-0840 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F228-0840
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F228-0840
  • 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 F228-0840 available by request