8388-1038 Screening compound: 5-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)pentan-1-amine

8388-1038 Screening compound: 5-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)pentan-1-amine
8388-1038 Screening compound: 5-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)pentan-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8388-1038
5-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)pentan-1-amine

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

8388-1038

Molecular Formula

C14H18FN3OS (C14 H18 FN3 OS)

Compound Name

5-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)pentan-1-amine

IUPAC name

5-(5-{[(4-fluorophenyl)methyl]sulfanyl}-134-oxadiazol-2-yl)pentan-1-amine

SMILES

NCCCCCc(o1)nnc1SCc(cc1)ccc1F

InChI

InChI=1S/C14H18FN3OS/c15-12-7-5-11(6-8-12)10-20-14-18-17-13(19-14)4-2-1-3-9-16/h5-8H,1-4,9-10,16H2

InChI Key

QJMPTUNWLPKBDC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04014194

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

295.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.567

Distribution Coefficient, logD

-1.006

Water Solubility, LogSw

-1.91

Polar Surface Area

51.157

Acid Dissociation Constant (pKa)

24.21

Base Dissociation Constant (pKb)

9.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

8388-1038 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8388-1038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8388-1038?
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What is the minimum amount of 8388-1038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8388-1038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8388-1038
  • 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 8388-1038 available by request