D157-0126 Screening compound: 2-{[8-ethyl-4-(4-fluorophenyl)quinazolin-2-yl]sulfanyl}-N-phenylacetamide

D157-0126 Screening compound: 2-{[8-ethyl-4-(4-fluorophenyl)quinazolin-2-yl]sulfanyl}-N-phenylacetamide
D157-0126 Screening compound: 2-{[8-ethyl-4-(4-fluorophenyl)quinazolin-2-yl]sulfanyl}-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D157-0126
2-{[8-ethyl-4-(4-fluorophenyl)quinazolin-2-yl]sulfanyl}-N-phenylacetamide

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

D157-0126

Molecular Formula

C24H20FN3OS (C24 H20 FN3 OS)

Compound Name

2-{[8-ethyl-4-(4-fluorophenyl)quinazolin-2-yl]sulfanyl}-N-phenylacetamide

IUPAC name

2-{[8-ethyl-4-(4-fluorophenyl)quinazolin-2-yl]sulfanyl}-N-phenylacetamide

SMILES

CCc(cccc1c(-c(cc2)ccc2F)n2)c1nc2SCC(Nc1ccccc1)=O

InChI

InChI=1S/C24H20FN3OS/c1-2-16-7-6-10-20-22(16)27-24(28-23(20)17-11-13-18(25)14-12-17)30-15-21(29)26-19-8-4-3-5-9-19/h3-14H,2,15H2,1H3,(H,26,29)

InChI Key

SVGUVAGVIFCHAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14813075

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.956

Distribution Coefficient, logD

5.956

Water Solubility, LogSw

-5.81

Polar Surface Area

41.394

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

1.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

D157-0126 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS Annotated Library (688 compounds)

Human GPCR Annotated Library (5539 compounds)

MCL1 Targeted Library (12200 compounds)

Akt-Targeted Library (14764 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
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D157-0126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D157-0126?
Check Price and Availability of D157-0126, 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 D157-0126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D157-0126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D157-0126
  • 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 D157-0126 available by request