E570-2180 Screening compound: 3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-benzyl-N-methylpropanamide

E570-2180 Screening compound: 3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-benzyl-N-methylpropanamide
E570-2180 Screening compound: 3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-benzyl-N-methylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E570-2180
3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-benzyl-N-methylpropanamide

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

E570-2180

Molecular Formula

C22H27N3O4S (C22 H27 N3 O4 S)

Compound Name

3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-benzyl-N-methylpropanamide

IUPAC name

3-(1-acetyl-2-methyl-23-dihydro-1H-indole-5-sulfonamido)-N-benzyl-N-methylpropanamide

SMILES

CC(C1)N(C(C)=O)c(cc2)c1cc2S(NCCC(N(C)Cc1ccccc1)=O)(=O)=O

InChI

InChI=1S/C22H27N3O4S/c1-16-13-19-14-20(9-10-21(19)25(16)17(2)26)30(28,29)23-12-11-22(27)24(3)15-18-7-5-4-6-8-18/h4-10,14,16,23H,11-13,15H2,1-3H3/t16-/m1/s1

InChI Key

BIOFWSUMRJLOQC-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD14899791

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.460

Distribution Coefficient, logD

2.460

Water Solubility, LogSw

-2.96

Polar Surface Area

73.090

Acid Dissociation Constant (pKa)

11.09

Base Dissociation Constant (pKb)

-2.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

E570-2180 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 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 E570-2180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E570-2180?
Check Price and Availability of E570-2180, 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 E570-2180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E570-2180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E570-2180
  • 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 E570-2180 available by request