3993-3722 Screening compound: 3-[(4-chlorophenyl)methyl]-3,4-dihydroquinazolin-4-one

3993-3722 Screening compound: 3-[(4-chlorophenyl)methyl]-3,4-dihydroquinazolin-4-one
3993-3722 Screening compound: 3-[(4-chlorophenyl)methyl]-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3993-3722
3-[(4-chlorophenyl)methyl]-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

3993-3722

Molecular Formula

C15H11ClN2O (C15 H11 ClN2 O)

Compound Name

3-[(4-chlorophenyl)methyl]-3,4-dihydroquinazolin-4-one

IUPAC name

3-[(4-chlorophenyl)methyl]-34-dihydroquinazolin-4-one

SMILES

O=C1N(Cc(cc2)ccc2Cl)C=Nc2c1cccc2

InChI

InChI=1S/C15H11ClN2O/c16-12-7-5-11(6-8-12)9-18-10-17-14-4-2-1-3-13(14)15(18)19/h1-8,10H,9H2

InChI Key

AKRYEYOAOUPPMF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02170595

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

270.72

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.562

Distribution Coefficient, logD

2.562

Water Solubility, LogSw

-3.34

Polar Surface Area

26.339

Acid Dissociation Constant (pKa)

30.81

Base Dissociation Constant (pKb)

1.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

3993-3722 in Drug Discovery

Included in Screening Libraries

Proline Kinase Library (2105 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
  • Nervous system
Targets:
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with 3993-3722 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3993-3722?
Check Price and Availability of 3993-3722, 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 3993-3722 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3993-3722
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3993-3722
  • 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 3993-3722 available by request