8011-8306 Screening compound: 3-(2-chlorophenyl)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-1,2,3,4-tetrahydroquinazolin-4-one

8011-8306 Screening compound: 3-(2-chlorophenyl)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-1,2,3,4-tetrahydroquinazolin-4-one
8011-8306 Screening compound: 3-(2-chlorophenyl)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-1,2,3,4-tetrahydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-8306
3-(2-chlorophenyl)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-1,2,3,4-tetrahydroquinazolin-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

8011-8306

Molecular Formula

C24H19ClN4O2 (C24 H19 ClN4 O2)

Compound Name

3-(2-chlorophenyl)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-1,2,3,4-tetrahydroquinazolin-4-one

IUPAC name

3-(2-chlorophenyl)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-1234-tetrahydroquinazolin-4-one

SMILES

Cc(c(C(Nc1c2cccc1)N(c(cccc1)c1Cl)C2=O)c1O)nn1-c1ccccc1

InChI

InChI=1S/C24H19ClN4O2/c1-15-21(24(31)29(27-15)16-9-3-2-4-10-16)22-26-19-13-7-5-11-17(19)23(30)28(22)20-14-8-6-12-18(20)25/h2-14,22,26,31H,1H3/t22-/m0/s1

InChI Key

XSPRRCOZJOVUOX-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD02625845

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.89

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.091

Distribution Coefficient, logD

3.428

Water Solubility, LogSw

-4.14

Polar Surface Area

56.280

Acid Dissociation Constant (pKa)

6.84

Base Dissociation Constant (pKb)

-2.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

8.30

8011-8306 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8011-8306 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-8306?
Check Price and Availability of 8011-8306, 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 8011-8306 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-8306
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-8306
  • 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 8011-8306 available by request