G500-0808 Screening compound: N-[2-(2,3-dihydro-1H-indol-1-yl)-2-[4-(dimethylamino)phenyl]ethyl]-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

G500-0808 Screening compound: N-[2-(2,3-dihydro-1H-indol-1-yl)-2-[4-(dimethylamino)phenyl]ethyl]-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide
G500-0808 Screening compound: N-[2-(2,3-dihydro-1H-indol-1-yl)-2-[4-(dimethylamino)phenyl]ethyl]-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G500-0808
N-[2-(2,3-dihydro-1H-indol-1-yl)-2-[4-(dimethylamino)phenyl]ethyl]-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

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

G500-0808

Molecular Formula

C28H28N4O3 (C28 H28 N4 O3)

Compound Name

N-[2-(2,3-dihydro-1H-indol-1-yl)-2-[4-(dimethylamino)phenyl]ethyl]-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

IUPAC name

N-[2-(23-dihydro-1H-indol-1-yl)-2-[4-(dimethylamino)phenyl]ethyl]-2-(13-dioxo-23-dihydro-1H-isoindol-2-yl)acetamide

SMILES

CN(C)c1ccc(C(CNC(CN(C(c2c3cccc2)=O)C3=O)=O)N(CC2)c3c2cccc3)cc1

InChI

InChI=1S/C28H28N4O3/c1-30(2)21-13-11-20(12-14-21)25(31-16-15-19-7-3-6-10-24(19)31)17-29-26(33)18-32-27(34)22-8-4-5-9-23(22)28(32)35/h3-14,25H,15-18H2,1-2H3,(H,29,33)/t25-/m0/s1

InChI Key

DWCWPEOOJVBPTI-VWLOTQADSA-N

MDL Number (MFCD)

MFCD08005544

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.646

Distribution Coefficient, logD

3.642

Water Solubility, LogSw

-3.82

Polar Surface Area

58.787

Acid Dissociation Constant (pKa)

14.51

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

G500-0808 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G500-0808 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G500-0808?
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What is the minimum amount of G500-0808 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G500-0808
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G500-0808
  • 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 G500-0808 available by request