K279-0605 Screening compound: N~1~-BENZYL-3-(5-{[2-(4-ETHYLANILINO)-2-OXOETHYL]SULFANYL}-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL)PROPANAMIDE

K279-0605 Screening compound: N~1~-BENZYL-3-(5-{[2-(4-ETHYLANILINO)-2-OXOETHYL]SULFANYL}-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL)PROPANAMIDE
K279-0605 Screening compound: N~1~-BENZYL-3-(5-{[2-(4-ETHYLANILINO)-2-OXOETHYL]SULFANYL}-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL)PROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound K279-0605
N~1~-BENZYL-3-(5-{[2-(4-ETHYLANILINO)-2-OXOETHYL]SULFANYL}-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL)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

K279-0605

Molecular Formula

C30H29N5O3S (C30 H29 N5 O3 S)

Compound Name

N~1~-BENZYL-3-(5-{[2-(4-ETHYLANILINO)-2-OXOETHYL]SULFANYL}-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL)PROPANAMIDE

IUPAC name

n/a

SMILES

CCc(cc1)ccc1NC(CSC(N1C2CCC(NCc3ccccc3)=O)=Nc(cccc3)c3C1=NC2=O)=O

InChI

InChI=1S/C30H29N5O3S/c1-2-20-12-14-22(15-13-20)32-27(37)19-39-30-33-24-11-7-6-10-23(24)28-34-29(38)25(35(28)30)16-17-26(36)31-18-21-8-4-3-5-9-21/h3-15,25H,2,16-19H2,1H3,(H,31,36)(H,32,37)/t25-/m0/s1

InChI Key

PXGWATQOYDQQNP-VWLOTQADSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

539.66

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.999

Distribution Coefficient, logD

3.998

Water Solubility, LogSw

-4.27

Polar Surface Area

82.772

Acid Dissociation Constant (pKa)

10.29

Base Dissociation Constant (pKb)

3.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.30

K279-0605 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 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 K279-0605 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K279-0605?
Check Price and Availability of K279-0605, 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 K279-0605 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K279-0605
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K279-0605
  • 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 K279-0605 available by request