E975-1362 Screening compound: N-(3-acetylphenyl)-5H,6H,7H,8H,9H,10H-cyclohepta[b]indole-2-sulfonamide

E975-1362 Screening compound: N-(3-acetylphenyl)-5H,6H,7H,8H,9H,10H-cyclohepta[b]indole-2-sulfonamide
E975-1362 Screening compound: N-(3-acetylphenyl)-5H,6H,7H,8H,9H,10H-cyclohepta[b]indole-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E975-1362
N-(3-acetylphenyl)-5H,6H,7H,8H,9H,10H-cyclohepta[b]indole-2-sulfonamide

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

E975-1362

Molecular Formula

C21H22N2O3S (C21 H22 N2 O3 S)

Compound Name

N-(3-acetylphenyl)-5H,6H,7H,8H,9H,10H-cyclohepta[b]indole-2-sulfonamide

IUPAC name

N-(3-acetylphenyl)-5H6H7H8H9H10H-cyclohepta[b]indole-2-sulfonamide

SMILES

CC(c1cccc(NS(c(cc2)cc3c2[nH]c2c3CCCCC2)(=O)=O)c1)=O

InChI

InChI=1S/C21H22N2O3S/c1-14(24)15-6-5-7-16(12-15)23-27(25,26)17-10-11-21-19(13-17)18-8-3-2-4-9-20(18)22-21/h5-7,10-13,22-23H,2-4,8-9H2,1H3

InChI Key

YJKYBTFZLHGPCG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14934245

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.883

Distribution Coefficient, logD

3.217

Water Solubility, LogSw

-4.06

Polar Surface Area

65.816

Acid Dissociation Constant (pKa)

6.84

Base Dissociation Constant (pKb)

-3.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

E975-1362 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

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

CNS targets activity set (6557 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with E975-1362 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E975-1362?
Check Price and Availability of E975-1362, 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 E975-1362 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E975-1362
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E975-1362
  • 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 E975-1362 available by request