Y020-1896 Screening compound: 1-(3-chloro-2-methylphenyl)-3-{[2-(1H-indol-3-yl)ethyl]amino}pyrrolidine-2,5-dione

Y020-1896 Screening compound: 1-(3-chloro-2-methylphenyl)-3-{[2-(1H-indol-3-yl)ethyl]amino}pyrrolidine-2,5-dione
Y020-1896 Screening compound: 1-(3-chloro-2-methylphenyl)-3-{[2-(1H-indol-3-yl)ethyl]amino}pyrrolidine-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-1896
1-(3-chloro-2-methylphenyl)-3-{[2-(1H-indol-3-yl)ethyl]amino}pyrrolidine-2,5-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

Y020-1896

Molecular Formula

C21H20ClN3O2 (C21 H20 ClN3 O2)

Compound Name

1-(3-chloro-2-methylphenyl)-3-{[2-(1H-indol-3-yl)ethyl]amino}pyrrolidine-2,5-dione

IUPAC name

1-(3-chloro-2-methylphenyl)-3-{[2-(1H-indol-3-yl)ethyl]amino}pyrrolidine-25-dione

SMILES

Cc(c(N(C(CC1NCCc2c[nH]c3c2cccc3)=O)C1=O)ccc1)c1Cl

InChI

InChI=1S/C21H20ClN3O2/c1-13-16(22)6-4-8-19(13)25-20(26)11-18(21(25)27)23-10-9-14-12-24-17-7-3-2-5-15(14)17/h2-8,12,18,23-24H,9-11H2,1H3/t18-/m1/s1

InChI Key

ADLGXZQYUVZHKK-GOSISDBHSA-N

MDL Number (MFCD)

MFCD07185997

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.86

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.659

Distribution Coefficient, logD

2.658

Water Solubility, LogSw

-3.41

Polar Surface Area

50.320

Acid Dissociation Constant (pKa)

16.53

Base Dissociation Constant (pKb)

5.01

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.80

Y020-1896 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 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 Y020-1896 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-1896?
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What is the minimum amount of Y020-1896 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-1896
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-1896
  • 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 Y020-1896 available by request