D419-2246 Screening compound: N-(4,6-diphenylpyrimidin-2-yl)-4-fluorobenzamide

D419-2246 Screening compound: N-(4,6-diphenylpyrimidin-2-yl)-4-fluorobenzamide
D419-2246 Screening compound: N-(4,6-diphenylpyrimidin-2-yl)-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D419-2246
N-(4,6-diphenylpyrimidin-2-yl)-4-fluorobenzamide

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

D419-2246

Molecular Formula

C23H16FN3O (C23 H16 FN3 O)

Compound Name

N-(4,6-diphenylpyrimidin-2-yl)-4-fluorobenzamide

IUPAC name

N-(46-diphenylpyrimidin-2-yl)-4-fluorobenzamide

SMILES

O=C(c(cc1)ccc1F)Nc1nc(-c2ccccc2)cc(-c2ccccc2)n1

InChI

InChI=1S/C23H16FN3O/c24-19-13-11-18(12-14-19)22(28)27-23-25-20(16-7-3-1-4-8-16)15-21(26-23)17-9-5-2-6-10-17/h1-15H,(H,25,26,27,28)

InChI Key

VFOOFZAHXHIGBW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14827865

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.870

Distribution Coefficient, logD

5.867

Water Solubility, LogSw

-6.11

Polar Surface Area

42.492

Acid Dissociation Constant (pKa)

9.51

Base Dissociation Constant (pKb)

1.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

D419-2246 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Human GPCR Annotated Library (5539 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D419-2246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D419-2246?
Check Price and Availability of D419-2246, 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 D419-2246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D419-2246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D419-2246
  • 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 D419-2246 available by request