F726-1353 Screening compound: N-{[4-(diethylamino)phenyl]methyl}-1-(2-phenylpyrimidin-4-yl)piperidine-3-carboxamide

F726-1353 Screening compound: N-{[4-(diethylamino)phenyl]methyl}-1-(2-phenylpyrimidin-4-yl)piperidine-3-carboxamide
F726-1353 Screening compound: N-{[4-(diethylamino)phenyl]methyl}-1-(2-phenylpyrimidin-4-yl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F726-1353
N-{[4-(diethylamino)phenyl]methyl}-1-(2-phenylpyrimidin-4-yl)piperidine-3-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

F726-1353

Molecular Formula

C27H33N5O (C27 H33 N5 O)

Compound Name

N-{[4-(diethylamino)phenyl]methyl}-1-(2-phenylpyrimidin-4-yl)piperidine-3-carboxamide

IUPAC name

N-{[4-(diethylamino)phenyl]methyl}-1-(2-phenylpyrimidin-4-yl)piperidine-3-carboxamide

SMILES

CCN(CC)c1ccc(CNC(C(CCC2)CN2c2nc(-c3ccccc3)ncc2)=O)cc1

InChI

InChI=1S/C27H33N5O/c1-3-31(4-2)24-14-12-21(13-15-24)19-29-27(33)23-11-8-18-32(20-23)25-16-17-28-26(30-25)22-9-6-5-7-10-22/h5-7,9-10,12-17,23H,3-4,8,11,18-20H2,1-2H3,(H,29,33)/t23-/m0/s1

InChI Key

VDKXKJCEGRVKRY-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD27188459

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.59

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.374

Distribution Coefficient, logD

4.070

Water Solubility, LogSw

-4.10

Polar Surface Area

48.969

Acid Dissociation Constant (pKa)

13.23

Base Dissociation Constant (pKb)

9.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.00

F726-1353 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F726-1353 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F726-1353?
Check Price and Availability of F726-1353, 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 F726-1353 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F726-1353
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F726-1353
  • 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 F726-1353 available by request