E511-5377 Screening compound: N-(2-chlorobenzyl)-1-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indol-5-yl)sulfonyl]-4-piperidinecarboxamide

E511-5377 Screening compound: N-(2-chlorobenzyl)-1-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indol-5-yl)sulfonyl]-4-piperidinecarboxamide
E511-5377 Screening compound: N-(2-chlorobenzyl)-1-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indol-5-yl)sulfonyl]-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E511-5377
N-(2-chlorobenzyl)-1-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indol-5-yl)sulfonyl]-4-piperidinecarboxamide

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

E511-5377

Molecular Formula

C24H28ClN3O4S (C24 H28 ClN3 O4 S)

Compound Name

N-(2-chlorobenzyl)-1-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indol-5-yl)sulfonyl]-4-piperidinecarboxamide

IUPAC name

N-[(2-chlorophenyl)methyl]-1-[(133-trimethyl-2-oxo-23-dihydro-1H-indol-5-yl)sulfonyl]piperidine-4-carboxamide

SMILES

CC(C)(c(cc(cc1)S(N(CC2)CCC2C(NCc(cccc2)c2Cl)=O)(=O)=O)c1N1C)C1=O

InChI

InChI=1S/C24H28ClN3O4S/c1-24(2)19-14-18(8-9-21(19)27(3)23(24)30)33(31,32)28-12-10-16(11-13-28)22(29)26-15-17-6-4-5-7-20(17)25/h4-9,14,16H,10-13,15H2,1-3H3,(H,26,29)

InChI Key

HFRTZOBHGXKZJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14893247

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.02

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.244

Distribution Coefficient, logD

3.244

Water Solubility, LogSw

-3.65

Polar Surface Area

71.869

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

-1.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.67

E511-5377 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Aurora A-B Kinases Targeted Library (9426 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
Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E511-5377 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E511-5377?
Check Price and Availability of E511-5377, 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 E511-5377 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E511-5377
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E511-5377
  • 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 E511-5377 available by request