K906-1420 Screening compound: N-(2,5-diethoxyphenyl)-2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-3-phenylpropanamide

K906-1420 Screening compound: N-(2,5-diethoxyphenyl)-2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-3-phenylpropanamide
K906-1420 Screening compound: N-(2,5-diethoxyphenyl)-2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-3-phenylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K906-1420
N-(2,5-diethoxyphenyl)-2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-3-phenylpropanamide

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

K906-1420

Molecular Formula

C28H31N3O6S (C28 H31 N3 O6 S)

Compound Name

N-(2,5-diethoxyphenyl)-2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-3-phenylpropanamide

IUPAC name

N-(25-diethoxyphenyl)-2-(2-oxo-1234-tetrahydroquinoline-6-sulfonamido)-3-phenylpropanamide

SMILES

CCOc(cc1)cc(NC(C(Cc2ccccc2)NS(c(cc2)cc(CC3)c2NC3=O)(=O)=O)=O)c1OCC

InChI

InChI=1S/C28H31N3O6S/c1-3-36-21-11-14-26(37-4-2)24(18-21)30-28(33)25(16-19-8-6-5-7-9-19)31-38(34,35)22-12-13-23-20(17-22)10-15-27(32)29-23/h5-9,11-14,17-18,25,31H,3-4,10,15-16H2,1-2H3,(H,29,32)(H,30,33)/t25-/m0/s1

InChI Key

HHBKOIBDUNYXEA-VWLOTQADSA-N

MDL Number (MFCD)

MFCD15112346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.64

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.168

Distribution Coefficient, logD

4.149

Water Solubility, LogSw

-4.20

Polar Surface Area

103.389

Acid Dissociation Constant (pKa)

8.76

Base Dissociation Constant (pKb)

-0.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

K906-1420 in Drug Discovery

Included in Screening Libraries

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

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with K906-1420 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K906-1420?
Check Price and Availability of K906-1420, 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 K906-1420 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K906-1420
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K906-1420
  • 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 K906-1420 available by request