E589-3164 Screening compound: N-(3,4-dimethylphenyl)-4-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamido)methyl]benzamide

E589-3164 Screening compound: N-(3,4-dimethylphenyl)-4-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamido)methyl]benzamide
E589-3164 Screening compound: N-(3,4-dimethylphenyl)-4-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamido)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E589-3164
N-(3,4-dimethylphenyl)-4-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamido)methyl]benzamide

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

E589-3164

Molecular Formula

C27H29N3O4S (C27 H29 N3 O4 S)

Compound Name

N-(3,4-dimethylphenyl)-4-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamido)methyl]benzamide

IUPAC name

N-(34-dimethylphenyl)-4-[(133-trimethyl-2-oxo-23-dihydro-1H-indole-5-sulfonamido)methyl]benzamide

SMILES

CC(C)(c(cc(cc1)S(NCc(cc2)ccc2C(Nc2cc(C)c(C)cc2)=O)(=O)=O)c1N1C)C1=O

InChI

InChI=1S/C27H29N3O4S/c1-17-6-11-21(14-18(17)2)29-25(31)20-9-7-19(8-10-20)16-28-35(33,34)22-12-13-24-23(15-22)27(3,4)26(32)30(24)5/h6-15,28H,16H2,1-5H3,(H,29,31)

InChI Key

ZFPWLXKTDVTKPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14900809

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.61

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.644

Distribution Coefficient, logD

4.643

Water Solubility, LogSw

-4.37

Polar Surface Area

80.594

Acid Dissociation Constant (pKa)

10.49

Base Dissociation Constant (pKb)

-1.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

E589-3164 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 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

References: we are preparing a list of scientific research reports with E589-3164 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E589-3164?
Check Price and Availability of E589-3164, 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 E589-3164 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E589-3164
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E589-3164
  • 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 E589-3164 available by request