3448-5404 Screening compound: 3-(4-chlorophenyl)-2-(1-phenylethyl)-1,2,3,4-tetrahydroquinazolin-4-one

3448-5404 Screening compound: 3-(4-chlorophenyl)-2-(1-phenylethyl)-1,2,3,4-tetrahydroquinazolin-4-one
3448-5404 Screening compound: 3-(4-chlorophenyl)-2-(1-phenylethyl)-1,2,3,4-tetrahydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3448-5404
3-(4-chlorophenyl)-2-(1-phenylethyl)-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

3448-5404

Molecular Formula

C22H19ClN2O (C22 H19 ClN2 O)

Compound Name

3-(4-chlorophenyl)-2-(1-phenylethyl)-1,2,3,4-tetrahydroquinazolin-4-one

IUPAC name

3-(4-chlorophenyl)-2-(1-phenylethyl)-1234-tetrahydroquinazolin-4-one

SMILES

CC(C(Nc1c2cccc1)N(c(cc1)ccc1Cl)C2=O)c1ccccc1

InChI

InChI=1S/C22H19ClN2O/c1-15(16-7-3-2-4-8-16)21-24-20-10-6-5-9-19(20)22(26)25(21)18-13-11-17(23)12-14-18/h2-15,21,24H,1H3

InChI Key

PICLVTIVPWKLBJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02029566

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.86

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.385

Distribution Coefficient, logD

5.385

Water Solubility, LogSw

-6.03

Polar Surface Area

26.731

Acid Dissociation Constant (pKa)

15.69

Base Dissociation Constant (pKb)

-2.13

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

13.60

3448-5404 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3448-5404 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3448-5404?
Check Price and Availability of 3448-5404, 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 3448-5404 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3448-5404
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3448-5404
  • 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 3448-5404 available by request