Y020-0866 Screening compound: 2-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]-2,3-dihydro-1H-isoindole-1,3-dione

Y020-0866 Screening compound: 2-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]-2,3-dihydro-1H-isoindole-1,3-dione
Y020-0866 Screening compound: 2-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]-2,3-dihydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-0866
2-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]-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

Y020-0866

Molecular Formula

C19H14N2O3 (C19 H14 N2 O3)

Compound Name

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

IUPAC name

2-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]-23-dihydro-1H-isoindole-13-dione

SMILES

Cc1c(C(CN(C(c2c3cccc2)=O)C3=O)=O)c(cccc2)c2[nH]1

InChI

InChI=1S/C19H14N2O3/c1-11-17(14-8-4-5-9-15(14)20-11)16(22)10-21-18(23)12-6-2-3-7-13(12)19(21)24/h2-9,20H,10H2,1H3

InChI Key

NNWUCJXARJEGFA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03904197

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.755

Distribution Coefficient, logD

2.755

Water Solubility, LogSw

-3.28

Polar Surface Area

52.664

Acid Dissociation Constant (pKa)

16.60

Base Dissociation Constant (pKb)

-3.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

Y020-0866 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with Y020-0866 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-0866?
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What is the minimum amount of Y020-0866 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-0866
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-0866
  • 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 Y020-0866 available by request