0KPI-0038 Screening compound: 2-[(adamantan-1-yl)methyl]-2,3-dihydro-1H-isoindole-1,3-dione

0KPI-0038 Screening compound: 2-[(adamantan-1-yl)methyl]-2,3-dihydro-1H-isoindole-1,3-dione
0KPI-0038 Screening compound: 2-[(adamantan-1-yl)methyl]-2,3-dihydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 0KPI-0038
2-[(adamantan-1-yl)methyl]-2,3-dihydro-1H-isoindole-1,3-dione

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-0038

Molecular Formula

C19H21NO2 (C19 H21 NO2)

Compound Name

2-[(adamantan-1-yl)methyl]-2,3-dihydro-1H-isoindole-1,3-dione

IUPAC name

2-[(adamantan-1-yl)methyl]-23-dihydro-1H-isoindole-13-dione

SMILES

O=C(c1c2cccc1)N(CC1(CC(C3)C4)CC4CC3C1)C2=O

InChI

InChI=1S/C19H21NO2/c21-17-15-3-1-2-4-16(15)18(22)20(17)11-19-8-12-5-13(9-19)7-14(6-12)10-19/h1-4,12-14H,5-11H2

InChI Key

NFKMLGTZGWTJTG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00220389

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

295.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.301

Distribution Coefficient, logD

4.301

Water Solubility, LogSw

-4.56

Polar Surface Area

29.525

Acid Dissociation Constant (pKa)

25.53

Base Dissociation Constant (pKb)

-6.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

References: we are preparing a list of scientific research reports with 0KPI-0038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0KPI-0038?
Check Price and Availability of 0KPI-0038, 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-0038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0KPI-0038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0KPI-0038
  • 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-0038 available by request