Y010-1253 Screening compound: 2-(4-bromophenyl)-5-[(4-phenoxybutyl)sulfanyl]-1,3,4-oxadiazole

Y010-1253 Screening compound: 2-(4-bromophenyl)-5-[(4-phenoxybutyl)sulfanyl]-1,3,4-oxadiazole
Y010-1253 Screening compound: 2-(4-bromophenyl)-5-[(4-phenoxybutyl)sulfanyl]-1,3,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound Y010-1253
2-(4-bromophenyl)-5-[(4-phenoxybutyl)sulfanyl]-1,3,4-oxadiazole

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

Y010-1253

Molecular Formula

C18H17BrN2O2S (C18 H17 BrN2 O2 S)

Compound Name

2-(4-bromophenyl)-5-[(4-phenoxybutyl)sulfanyl]-1,3,4-oxadiazole

IUPAC name

2-(4-bromophenyl)-5-[(4-phenoxybutyl)sulfanyl]-134-oxadiazole

SMILES

Brc(cc1)ccc1-c(o1)nnc1SCCCCOc1ccccc1

InChI

InChI=1S/C18H17BrN2O2S/c19-15-10-8-14(9-11-15)17-20-21-18(23-17)24-13-5-4-12-22-16-6-2-1-3-7-16/h1-3,6-11H,4-5,12-13H2

InChI Key

CJAPFDGVNUFFHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02106895

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.461

Distribution Coefficient, logD

5.461

Water Solubility, LogSw

-5.89

Polar Surface Area

37.482

Acid Dissociation Constant (pKa)

26.27

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

Y010-1253 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y010-1253 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y010-1253?
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What is the minimum amount of Y010-1253 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y010-1253
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y010-1253
  • 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 Y010-1253 available by request