E786-0475 Screening compound: N-cyclooctyl-3-[(1-cyclopropanecarbonyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide

E786-0475 Screening compound: N-cyclooctyl-3-[(1-cyclopropanecarbonyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide
E786-0475 Screening compound: N-cyclooctyl-3-[(1-cyclopropanecarbonyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E786-0475
N-cyclooctyl-3-[(1-cyclopropanecarbonyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]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

E786-0475

Molecular Formula

C24H34N2O4S (C24 H34 N2 O4 S)

Compound Name

N-cyclooctyl-3-[(1-cyclopropanecarbonyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide

IUPAC name

N-cyclooctyl-3-[(1-cyclopropanecarbonyl-2-methyl-23-dihydro-1H-indol-5-yl)sulfonyl]propanamide

SMILES

CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(CCC(NC1CCCCCCC1)=O)(=O)=O

InChI

InChI=1S/C24H34N2O4S/c1-17-15-19-16-21(11-12-22(19)26(17)24(28)18-9-10-18)31(29,30)14-13-23(27)25-20-7-5-3-2-4-6-8-20/h11-12,16-18,20H,2-10,13-15H2,1H3,(H,25,27)/t17-/m1/s1

InChI Key

ALCAONGQAUHAFS-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD14918611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.775

Distribution Coefficient, logD

3.775

Water Solubility, LogSw

-4.01

Polar Surface Area

68.672

Acid Dissociation Constant (pKa)

14.07

Base Dissociation Constant (pKb)

-0.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.70

E786-0475 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with E786-0475 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E786-0475?
Check Price and Availability of E786-0475, 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 E786-0475 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E786-0475
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E786-0475
  • 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 E786-0475 available by request