4483-0981 Screening compound: butyl 2,6-bis(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanoate

4483-0981 Screening compound: butyl 2,6-bis(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanoate
4483-0981 Screening compound: butyl 2,6-bis(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4483-0981
butyl 2,6-bis(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanoate

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

4483-0981

Molecular Formula

C26H26N2O6 (C26 H26 N2 O6)

Compound Name

butyl 2,6-bis(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanoate

IUPAC name

butyl 26-bis(13-dioxo-23-dihydro-1H-isoindol-2-yl)hexanoate

SMILES

CCCCOC(C(CCCCN(C(c1c2cccc1)=O)C2=O)N(C(c1c2cccc1)=O)C2=O)=O

InChI

InChI=1S/C26H26N2O6/c1-2-3-16-34-26(33)21(28-24(31)19-12-6-7-13-20(19)25(28)32)14-8-9-15-27-22(29)17-10-4-5-11-18(17)23(27)30/h4-7,10-13,21H,2-3,8-9,14-16H2,1H3/t21-/m0/s1

InChI Key

KBTUHDHLPPXMPY-NRFANRHFSA-N

MDL Number (MFCD)

MFCD01046657

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.5

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.599

Distribution Coefficient, logD

4.599

Water Solubility, LogSw

-4.48

Polar Surface Area

78.967

Acid Dissociation Constant (pKa)

22.06

Base Dissociation Constant (pKb)

-6.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with 4483-0981 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4483-0981?
Check Price and Availability of 4483-0981, 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 4483-0981 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4483-0981
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4483-0981
  • 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 4483-0981 available by request