K505-0797 Screening compound: N-(4-{2-[(1E)-2-(4-tert-butylphenyl)ethenyl]-7-chloro-4-oxo-3,4-dihydroquinazolin-3-yl}phenyl)acetamide

K505-0797 Screening compound: N-(4-{2-[(1E)-2-(4-tert-butylphenyl)ethenyl]-7-chloro-4-oxo-3,4-dihydroquinazolin-3-yl}phenyl)acetamide
K505-0797 Screening compound: N-(4-{2-[(1E)-2-(4-tert-butylphenyl)ethenyl]-7-chloro-4-oxo-3,4-dihydroquinazolin-3-yl}phenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K505-0797
N-(4-{2-[(1E)-2-(4-tert-butylphenyl)ethenyl]-7-chloro-4-oxo-3,4-dihydroquinazolin-3-yl}phenyl)acetamide

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

K505-0797

Molecular Formula

C28H26ClN3O2 (C28 H26 ClN3 O2)

Compound Name

N-(4-{2-[(1E)-2-(4-tert-butylphenyl)ethenyl]-7-chloro-4-oxo-3,4-dihydroquinazolin-3-yl}phenyl)acetamide

IUPAC name

N-(4-{2-[(1E)-2-(4-tert-butylphenyl)ethenyl]-7-chloro-4-oxo-34-dihydroquinazolin-3-yl}phenyl)acetamide

SMILES

CC(C)(C)c1ccc(/C=C/C(N2c(cc3)ccc3NC(C)=O)=Nc(cc(cc3)Cl)c3C2=O)cc1

InChI

InChI=1S/C28H26ClN3O2/c1-18(33)30-22-11-13-23(14-12-22)32-26(31-25-17-21(29)10-15-24(25)27(32)34)16-7-19-5-8-20(9-6-19)28(2,3)4/h5-17H,1-4H3,(H,30,33)

InChI Key

SKNSEGXEFKHDIS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01934256

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.99

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.893

Distribution Coefficient, logD

5.893

Water Solubility, LogSw

-6.05

Polar Surface Area

47.856

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

3.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.90

K505-0797 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with K505-0797 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K505-0797?
Check Price and Availability of K505-0797, 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 K505-0797 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K505-0797
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K505-0797
  • 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 K505-0797 available by request