0159-0066 Screening compound: ethyl 3-[3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propyl]-5-ethoxy-1H-indole-2-carboxylate

0159-0066 Screening compound: ethyl 3-[3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propyl]-5-ethoxy-1H-indole-2-carboxylate
0159-0066 Screening compound: ethyl 3-[3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propyl]-5-ethoxy-1H-indole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0159-0066
ethyl 3-[3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propyl]-5-ethoxy-1H-indole-2-carboxylate

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

0159-0066

Molecular Formula

C24H24N2O5 (C24 H24 N2 O5)

Compound Name

ethyl 3-[3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propyl]-5-ethoxy-1H-indole-2-carboxylate

IUPAC name

ethyl 3-[3-(13-dioxo-23-dihydro-1H-isoindol-2-yl)propyl]-5-ethoxy-1H-indole-2-carboxylate

SMILES

CCOC(c1c(CCCN(C(c2c3cccc2)=O)C3=O)c(cc(cc2)OCC)c2[nH]1)=O

InChI

InChI=1S/C24H24N2O5/c1-3-30-15-11-12-20-19(14-15)16(21(25-20)24(29)31-4-2)10-7-13-26-22(27)17-8-5-6-9-18(17)23(26)28/h5-6,8-9,11-12,14,25H,3-4,7,10,13H2,1-2H3

InChI Key

LVTULNPDCBWXEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00337228

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.846

Distribution Coefficient, logD

3.846

Water Solubility, LogSw

-4.08

Polar Surface Area

67.467

Acid Dissociation Constant (pKa)

15.67

Base Dissociation Constant (pKb)

-3.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

0159-0066 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0159-0066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0159-0066?
Check Price and Availability of 0159-0066, 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 0159-0066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0159-0066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0159-0066
  • 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 0159-0066 available by request