5173-3898 Screening compound: N4-[2-(4-methoxyphenyl)quinazolin-4-yl]-N1,N1-dimethylbenzene-1,4-diamine

5173-3898 Screening compound: N4-[2-(4-methoxyphenyl)quinazolin-4-yl]-N1,N1-dimethylbenzene-1,4-diamine
5173-3898 Screening compound: N4-[2-(4-methoxyphenyl)quinazolin-4-yl]-N1,N1-dimethylbenzene-1,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5173-3898
N4-[2-(4-methoxyphenyl)quinazolin-4-yl]-N1,N1-dimethylbenzene-1,4-diamine

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

5173-3898

Molecular Formula

C23H22N4O (C23 H22 N4 O)

Compound Name

N4-[2-(4-methoxyphenyl)quinazolin-4-yl]-N1,N1-dimethylbenzene-1,4-diamine

IUPAC name

N4-[2-(4-methoxyphenyl)quinazolin-4-yl]-N1N1-dimethylbenzene-14-diamine

SMILES

CN(C)c(cc1)ccc1Nc1nc(-c(cc2)ccc2OC)nc2ccccc12

InChI

InChI=1S/C23H22N4O/c1-27(2)18-12-10-17(11-13-18)24-23-20-6-4-5-7-21(20)25-22(26-23)16-8-14-19(28-3)15-9-16/h4-15H,1-3H3,(H,24,25,26)

InChI Key

HRVQOMSVVQYDLX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02961499

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.093

Distribution Coefficient, logD

6.056

Water Solubility, LogSw

-6.03

Polar Surface Area

38.154

Acid Dissociation Constant (pKa)

19.11

Base Dissociation Constant (pKb)

6.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

5173-3898 in Drug Discovery

Included in Screening Libraries

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
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 5173-3898 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5173-3898?
Check Price and Availability of 5173-3898, 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 5173-3898 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5173-3898
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5173-3898
  • 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 5173-3898 available by request