F517-0016 Screening compound: 3-phenyl-N-[3-(1H-1,2,3,4-tetrazol-1-yl)phenyl]propanamide

F517-0016 Screening compound: 3-phenyl-N-[3-(1H-1,2,3,4-tetrazol-1-yl)phenyl]propanamide
F517-0016 Screening compound: 3-phenyl-N-[3-(1H-1,2,3,4-tetrazol-1-yl)phenyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F517-0016
3-phenyl-N-[3-(1H-1,2,3,4-tetrazol-1-yl)phenyl]propanamide

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

F517-0016

Molecular Formula

C16H15N5O (C16 H15 N5 O)

Compound Name

3-phenyl-N-[3-(1H-1,2,3,4-tetrazol-1-yl)phenyl]propanamide

IUPAC name

3-phenyl-N-[3-(1H-1234-tetrazol-1-yl)phenyl]propanamide

SMILES

O=C(CCc1ccccc1)Nc1cc(-n2nnnc2)ccc1

InChI

InChI=1S/C16H15N5O/c22-16(10-9-13-5-2-1-3-6-13)18-14-7-4-8-15(11-14)21-12-17-19-20-21/h1-8,11-12H,9-10H2,(H,18,22)

InChI Key

DVPFFSOVJHQMSM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03641149

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.758

Distribution Coefficient, logD

2.758

Water Solubility, LogSw

-3.30

Polar Surface Area

62.882

Acid Dissociation Constant (pKa)

12.52

Base Dissociation Constant (pKb)

-0.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

F517-0016 in Drug Discovery

Included in Screening Libraries

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

RAR (Nuclear receptors) Ligands Library (6524 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F517-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F517-0016?
Check Price and Availability of F517-0016, 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 F517-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F517-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F517-0016
  • 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 F517-0016 available by request