D163-0726 Screening compound: 2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-phenyl-3,4-dihydroquinazolin-4-one

D163-0726 Screening compound: 2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-phenyl-3,4-dihydroquinazolin-4-one
D163-0726 Screening compound: 2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-phenyl-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D163-0726
2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-phenyl-3,4-dihydroquinazolin-4-one

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

D163-0726

Molecular Formula

C25H19N3O (C25 H19 N3 O)

Compound Name

2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-phenyl-3,4-dihydroquinazolin-4-one

IUPAC name

2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-phenyl-34-dihydroquinazolin-4-one

SMILES

Cc1c(/C=C/C(N2c3ccccc3)=Nc(cccc3)c3C2=O)c(cccc2)c2[nH]1

InChI

InChI=1S/C25H19N3O/c1-17-19(20-11-5-7-13-22(20)26-17)15-16-24-27-23-14-8-6-12-21(23)25(29)28(24)18-9-3-2-4-10-18/h2-16,26H,1H3

InChI Key

ORCPRXTWJDDNHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01558940

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.203

Distribution Coefficient, logD

4.201

Water Solubility, LogSw

-4.38

Polar Surface Area

34.520

Acid Dissociation Constant (pKa)

18.23

Base Dissociation Constant (pKb)

4.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

D163-0726 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Targeted Diversity Library (40567 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 D163-0726 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D163-0726?
Check Price and Availability of D163-0726, 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 D163-0726 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D163-0726
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D163-0726
  • 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 D163-0726 available by request