Y502-6987 Screening compound: 2-[3-(3-chloro-1H-1,2,4-triazol-1-yl)-1-adamantyl]-5-(2-pyridyl)-1,3,4-oxadiazole

Y502-6987 Screening compound: 2-[3-(3-chloro-1H-1,2,4-triazol-1-yl)-1-adamantyl]-5-(2-pyridyl)-1,3,4-oxadiazole
Y502-6987 Screening compound: 2-[3-(3-chloro-1H-1,2,4-triazol-1-yl)-1-adamantyl]-5-(2-pyridyl)-1,3,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound Y502-6987
2-[3-(3-chloro-1H-1,2,4-triazol-1-yl)-1-adamantyl]-5-(2-pyridyl)-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

Y502-6987

Molecular Formula

C19H19ClN6O (C19 H19 ClN6 O)

Compound Name

2-[3-(3-chloro-1H-1,2,4-triazol-1-yl)-1-adamantyl]-5-(2-pyridyl)-1,3,4-oxadiazole

IUPAC name

2-{5-[3-(3-chloro-1H-124-triazol-1-yl)adamantan-1-yl]-134-oxadiazol-2-yl}pyridine

SMILES

Clc1nn(C(CC(C2)C3)(CC2C2)CC23c2nnc(-c3ncccc3)o2)cn1

InChI

InChI=1S/C19H19ClN6O/c20-17-22-11-26(25-17)19-8-12-5-13(9-19)7-18(6-12,10-19)16-24-23-15(27-16)14-3-1-2-4-21-14/h1-4,11-13H,5-10H2

InChI Key

NTUHJLXLSWUPTE-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.85

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.319

Distribution Coefficient, logD

3.319

Water Solubility, LogSw

-3.46

Polar Surface Area

62.896

Acid Dissociation Constant (pKa)

24.23

Base Dissociation Constant (pKb)

2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.63

References: we are preparing a list of scientific research reports with Y502-6987 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y502-6987?
Check Price and Availability of Y502-6987, 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 Y502-6987 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y502-6987
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y502-6987
  • 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 Y502-6987 available by request