K906-0829 Screening compound: N-[2-(3,4-DIETHOXYPHENYL)ETHYL]-3-(4-METHOXYBENZENESULFONYL)PROPANAMIDE

K906-0829 Screening compound: N-[2-(3,4-DIETHOXYPHENYL)ETHYL]-3-(4-METHOXYBENZENESULFONYL)PROPANAMIDE
K906-0829 Screening compound: N-[2-(3,4-DIETHOXYPHENYL)ETHYL]-3-(4-METHOXYBENZENESULFONYL)PROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound K906-0829
N-[2-(3,4-DIETHOXYPHENYL)ETHYL]-3-(4-METHOXYBENZENESULFONYL)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

K906-0829

Molecular Formula

C22H29NO6S (C22 H29 NO6 S)

Compound Name

N-[2-(3,4-DIETHOXYPHENYL)ETHYL]-3-(4-METHOXYBENZENESULFONYL)PROPANAMIDE

IUPAC name

n/a

SMILES

CCOc(ccc(CCNC(CCS(c(cc1)ccc1OC)(=O)=O)=O)c1)c1OCC

InChI

InChI=1S/C22H29NO6S/c1-4-28-20-11-6-17(16-21(20)29-5-2)12-14-23-22(24)13-15-30(25,26)19-9-7-18(27-3)8-10-19/h6-11,16H,4-5,12-15H2,1-3H3,(H,23,24)

InChI Key

DGWDDXUPGCHTGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15112232

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.726

Distribution Coefficient, logD

1.726

Water Solubility, LogSw

-2.47

Polar Surface Area

75.280

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

-2.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

K906-0829 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 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
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with K906-0829 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K906-0829?
Check Price and Availability of K906-0829, 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 K906-0829 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K906-0829
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K906-0829
  • 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 K906-0829 available by request