0KPI-0083 Screening compound: 4-(adamantan-1-yl)-2-methyl-1,3-oxazole

0KPI-0083 Screening compound: 4-(adamantan-1-yl)-2-methyl-1,3-oxazole
0KPI-0083 Screening compound: 4-(adamantan-1-yl)-2-methyl-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0KPI-0083
4-(adamantan-1-yl)-2-methyl-1,3-oxazole

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

0KPI-0083

Molecular Formula

C14H19NO (C14 H19 NO)

Compound Name

4-(adamantan-1-yl)-2-methyl-1,3-oxazole

IUPAC name

4-(adamantan-1-yl)-2-methyl-13-oxazole

SMILES

Cc1nc(C2(CC(C3)C4)CC4CC3C2)co1

InChI

InChI=1S/C14H19NO/c1-9-15-13(8-16-9)14-5-10-2-11(6-14)4-12(3-10)7-14/h8,10-12H,2-7H2,1H3

InChI Key

FTTNFYSXKRFCCW-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

217.31

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.042

Distribution Coefficient, logD

4.042

Water Solubility, LogSw

-4.04

Polar Surface Area

17.968

Acid Dissociation Constant (pKa)

24.63

Base Dissociation Constant (pKb)

3.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

78.60

0KPI-0083 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 0KPI-0083 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0KPI-0083?
Check Price and Availability of 0KPI-0083, 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 0KPI-0083 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0KPI-0083
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0KPI-0083
  • 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 0KPI-0083 available by request