S569-0528 Screening compound: N-(3-fluorophenyl)-3-(1-methyl-1H-1,2,3,4-tetrazol-5-yl)piperidine-1-carboxamide

S569-0528 Screening compound: N-(3-fluorophenyl)-3-(1-methyl-1H-1,2,3,4-tetrazol-5-yl)piperidine-1-carboxamide
S569-0528 Screening compound: N-(3-fluorophenyl)-3-(1-methyl-1H-1,2,3,4-tetrazol-5-yl)piperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S569-0528
N-(3-fluorophenyl)-3-(1-methyl-1H-1,2,3,4-tetrazol-5-yl)piperidine-1-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

S569-0528

Molecular Formula

C14H17FN6O (C14 H17 FN6 O)

Compound Name

N-(3-fluorophenyl)-3-(1-methyl-1H-1,2,3,4-tetrazol-5-yl)piperidine-1-carboxamide

IUPAC name

N-(3-fluorophenyl)-3-(1-methyl-1H-1234-tetrazol-5-yl)piperidine-1-carboxamide

SMILES

Cn1nnnc1C(CCC1)CN1C(Nc1cccc(F)c1)=O

InChI

InChI=1S/C14H17FN6O/c1-20-13(17-18-19-20)10-4-3-7-21(9-10)14(22)16-12-6-2-5-11(15)8-12/h2,5-6,8,10H,3-4,7,9H2,1H3,(H,16,22)/t10-/m0/s1

InChI Key

GSJAOKTZQDOHOS-JTQLQIEISA-N

MDL Number (MFCD)

MFCD31961208

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.435

Distribution Coefficient, logD

1.435

Water Solubility, LogSw

-2.05

Polar Surface Area

65.131

Acid Dissociation Constant (pKa)

12.05

Base Dissociation Constant (pKb)

2.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.86

S569-0528 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S569-0528 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S569-0528?
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What is the minimum amount of S569-0528 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S569-0528
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S569-0528
  • 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 S569-0528 available by request