D163-0860 Screening compound: 3-(3-hydroxypropyl)-2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3,4-dihydroquinazolin-4-one

D163-0860 Screening compound: 3-(3-hydroxypropyl)-2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3,4-dihydroquinazolin-4-one
D163-0860 Screening compound: 3-(3-hydroxypropyl)-2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D163-0860
3-(3-hydroxypropyl)-2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-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

D163-0860

Molecular Formula

C22H21N3O2 (C22 H21 N3 O2)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(/C=C/C(N2CCCO)=Nc(cccc3)c3C2=O)c(cccc2)c2[nH]1

InChI

InChI=1S/C22H21N3O2/c1-15-16(17-7-2-4-9-19(17)23-15)11-12-21-24-20-10-5-3-8-18(20)22(27)25(21)13-6-14-26/h2-5,7-12,23,26H,6,13-14H2,1H3

InChI Key

HBDSNIOZAKSKBK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03177215

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.799

Distribution Coefficient, logD

2.799

Water Solubility, LogSw

-3.33

Polar Surface Area

52.037

Acid Dissociation Constant (pKa)

15.69

Base Dissociation Constant (pKb)

2.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

D163-0860 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D163-0860 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D163-0860?
Check Price and Availability of D163-0860, 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 D163-0860 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D163-0860
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D163-0860
  • 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 D163-0860 available by request