4491-0390 Screening compound: 2-(4-chlorophenyl)-N-(3-methylphenyl)quinazolin-4-amine

4491-0390 Screening compound: 2-(4-chlorophenyl)-N-(3-methylphenyl)quinazolin-4-amine
4491-0390 Screening compound: 2-(4-chlorophenyl)-N-(3-methylphenyl)quinazolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4491-0390
2-(4-chlorophenyl)-N-(3-methylphenyl)quinazolin-4-amine

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

4491-0390

Molecular Formula

C21H16ClN3 (C21 H16 ClN3)

Compound Name

2-(4-chlorophenyl)-N-(3-methylphenyl)quinazolin-4-amine

IUPAC name

2-(4-chlorophenyl)-N-(3-methylphenyl)quinazolin-4-amine

SMILES

Cc1cccc(Nc2nc(-c(cc3)ccc3Cl)nc3ccccc23)c1

InChI

InChI=1S/C21H16ClN3/c1-14-5-4-6-17(13-14)23-21-18-7-2-3-8-19(18)24-20(25-21)15-9-11-16(22)12-10-15/h2-13H,1H3,(H,23,24,25)

InChI Key

UWDUPLWUYFZOPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02999120

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

345.83

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

6.975

Distribution Coefficient, logD

6.917

Water Solubility, LogSw

-6.69

Polar Surface Area

27.805

Acid Dissociation Constant (pKa)

19.47

Base Dissociation Constant (pKb)

6.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

4491-0390 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anticancer Library (62698 compounds)

Epigenetics Focused Set (26518 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 4491-0390 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4491-0390?
Check Price and Availability of 4491-0390, 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 4491-0390 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4491-0390
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4491-0390
  • 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 4491-0390 available by request