G806-0416 Screening compound: ethyl 3-[2-(N-methyl1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamido)acetamido]benzoate

G806-0416 Screening compound: ethyl 3-[2-(N-methyl1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamido)acetamido]benzoate
G806-0416 Screening compound: ethyl 3-[2-(N-methyl1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamido)acetamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G806-0416
ethyl 3-[2-(N-methyl1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamido)acetamido]benzoate

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

G806-0416

Molecular Formula

C23H27N3O6S (C23 H27 N3 O6 S)

Compound Name

ethyl 3-[2-(N-methyl1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamido)acetamido]benzoate

IUPAC name

ethyl 3-[2-(N-methyl133-trimethyl-2-oxo-23-dihydro-1H-indole-5-sulfonamido)acetamido]benzoate

SMILES

CCOC(c1cccc(NC(CN(C)S(c(cc2)cc(C3(C)C)c2N(C)C3=O)(=O)=O)=O)c1)=O

InChI

InChI=1S/C23H27N3O6S/c1-6-32-21(28)15-8-7-9-16(12-15)24-20(27)14-25(4)33(30,31)17-10-11-19-18(13-17)23(2,3)22(29)26(19)5/h7-13H,6,14H2,1-5H3,(H,24,27)

InChI Key

SDBIIOGOLYFGBE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15038208

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.55

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.443

Distribution Coefficient, logD

3.443

Water Solubility, LogSw

-3.90

Polar Surface Area

92.212

Acid Dissociation Constant (pKa)

11.25

Base Dissociation Constant (pKb)

-2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

G806-0416 in Drug Discovery

Included in Screening Libraries

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

Hsp90-Targeted Library (11355 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with G806-0416 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G806-0416?
Check Price and Availability of G806-0416, 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 G806-0416 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G806-0416
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G806-0416
  • 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 G806-0416 available by request