3461-3264 Screening compound: 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl 4-chlorobenzoate

3461-3264 Screening compound: 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl 4-chlorobenzoate
3461-3264 Screening compound: 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl 4-chlorobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3461-3264
2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl 4-chlorobenzoate

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

3461-3264

Molecular Formula

C17H12ClNO4 (C17 H12 ClNO4)

Compound Name

2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl 4-chlorobenzoate

IUPAC name

2-(13-dioxo-23-dihydro-1H-isoindol-2-yl)ethyl 4-chlorobenzoate

SMILES

O=C(c(cc1)ccc1Cl)OCCN(C(c1c2cccc1)=O)C2=O

InChI

InChI=1S/C17H12ClNO4/c18-12-7-5-11(6-8-12)17(22)23-10-9-19-15(20)13-3-1-2-4-14(13)16(19)21/h1-8H,9-10H2

InChI Key

NOFBDLIXYGYURJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02346088

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.74

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.624

Distribution Coefficient, logD

3.624

Water Solubility, LogSw

-4.14

Polar Surface Area

50.518

Acid Dissociation Constant (pKa)

29.97

Base Dissociation Constant (pKb)

-7.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

References: we are preparing a list of scientific research reports with 3461-3264 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3461-3264?
Check Price and Availability of 3461-3264, 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 3461-3264 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3461-3264
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3461-3264
  • 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 3461-3264 available by request