8011-8166 Screening compound: 2-{[(3Z)-5-bromo-1-methyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-3-(3-methoxyphenyl)-3,4-dihydroquinazolin-4-one

8011-8166 Screening compound: 2-{[(3Z)-5-bromo-1-methyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-3-(3-methoxyphenyl)-3,4-dihydroquinazolin-4-one
8011-8166 Screening compound: 2-{[(3Z)-5-bromo-1-methyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-3-(3-methoxyphenyl)-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-8166
2-{[(3Z)-5-bromo-1-methyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-3-(3-methoxyphenyl)-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

8011-8166

Molecular Formula

C25H18BrN3O3 (C25 H18 BrN3 O3)

Compound Name

2-{[(3Z)-5-bromo-1-methyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-3-(3-methoxyphenyl)-3,4-dihydroquinazolin-4-one

IUPAC name

2-{[(3Z)-5-bromo-1-methyl-2-oxo-23-dihydro-1H-indol-3-ylidene]methyl}-3-(3-methoxyphenyl)-34-dihydroquinazolin-4-one

SMILES

CN(c(ccc(Br)c1)c1/C1=C/C(N2c3cc(OC)ccc3)=Nc(cccc3)c3C2=O)C1=O

InChI

InChI=1S/C25H18BrN3O3/c1-28-22-11-10-15(26)12-19(22)20(24(28)30)14-23-27-21-9-4-3-8-18(21)25(31)29(23)16-6-5-7-17(13-16)32-2/h3-14H,1-2H3

InChI Key

QQLMZADZMWGKOY-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.996

Distribution Coefficient, logD

3.996

Water Solubility, LogSw

-4.34

Polar Surface Area

47.644

Acid Dissociation Constant (pKa)

28.65

Base Dissociation Constant (pKb)

4.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

References: we are preparing a list of scientific research reports with 8011-8166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-8166?
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What is the minimum amount of 8011-8166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-8166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-8166
  • 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 8011-8166 available by request