E570-2226 Screening compound: 3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-(4-ethoxyphenyl)propanamide

E570-2226 Screening compound: 3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-(4-ethoxyphenyl)propanamide
E570-2226 Screening compound: 3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-(4-ethoxyphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E570-2226
3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-(4-ethoxyphenyl)propanamide

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

E570-2226

Molecular Formula

C22H27N3O5S (C22 H27 N3 O5 S)

Compound Name

3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-(4-ethoxyphenyl)propanamide

IUPAC name

3-(1-acetyl-2-methyl-23-dihydro-1H-indole-5-sulfonamido)-N-(4-ethoxyphenyl)propanamide

SMILES

CCOc(cc1)ccc1NC(CCNS(c(cc1)cc(CC2C)c1N2C(C)=O)(=O)=O)=O

InChI

InChI=1S/C22H27N3O5S/c1-4-30-19-7-5-18(6-8-19)24-22(27)11-12-23-31(28,29)20-9-10-21-17(14-20)13-15(2)25(21)16(3)26/h5-10,14-15,23H,4,11-13H2,1-3H3,(H,24,27)/t15-/m1/s1

InChI Key

JNACVVWTDDVCOE-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD14899815

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.597

Distribution Coefficient, logD

2.597

Water Solubility, LogSw

-3.23

Polar Surface Area

87.468

Acid Dissociation Constant (pKa)

10.96

Base Dissociation Constant (pKb)

0.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

E570-2226 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Human Kinases Annotated Library (2415 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with E570-2226 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E570-2226?
Check Price and Availability of E570-2226, 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 E570-2226 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E570-2226
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E570-2226
  • 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 E570-2226 available by request