Y010-1498 Screening compound: 2-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-1,3,4-oxadiazole

Y010-1498 Screening compound: 2-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-1,3,4-oxadiazole
Y010-1498 Screening compound: 2-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-1,3,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound Y010-1498
2-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)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

Y010-1498

Molecular Formula

C13H14N2O2S (C13 H14 N2 O2 S)

Compound Name

2-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-1,3,4-oxadiazole

IUPAC name

2-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-134-oxadiazole

SMILES

CC(CSc1nnc(-c(cc2)ccc2OC)o1)=C

InChI

InChI=1S/C13H14N2O2S/c1-9(2)8-18-13-15-14-12(17-13)10-4-6-11(16-3)7-5-10/h4-7H,1,8H2,2-3H3

InChI Key

DDGQRKISNRFHFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07697486

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

262.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.340

Distribution Coefficient, logD

3.340

Water Solubility, LogSw

-3.36

Polar Surface Area

37.879

Acid Dissociation Constant (pKa)

29.88

Base Dissociation Constant (pKb)

-4.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

Y010-1498 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y010-1498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y010-1498?
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What is the minimum amount of Y010-1498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y010-1498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y010-1498
  • 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 Y010-1498 available by request