3651-6389 Screening compound: 2-(3,4-dimethoxyphenyl)-N-(4-nitrophenyl)quinazolin-4-amine

3651-6389 Screening compound: 2-(3,4-dimethoxyphenyl)-N-(4-nitrophenyl)quinazolin-4-amine
3651-6389 Screening compound: 2-(3,4-dimethoxyphenyl)-N-(4-nitrophenyl)quinazolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3651-6389
2-(3,4-dimethoxyphenyl)-N-(4-nitrophenyl)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

3651-6389

Molecular Formula

C22H18N4O4 (C22 H18 N4 O4)

Compound Name

2-(3,4-dimethoxyphenyl)-N-(4-nitrophenyl)quinazolin-4-amine

IUPAC name

2-(34-dimethoxyphenyl)-N-(4-nitrophenyl)quinazolin-4-amine

SMILES

COc(ccc(-c1nc2ccccc2c(Nc(cc2)ccc2[N+]([O-])=O)n1)c1)c1OC

InChI

InChI=1S/C22H18N4O4/c1-29-19-12-7-14(13-20(19)30-2)21-24-18-6-4-3-5-17(18)22(25-21)23-15-8-10-16(11-9-15)26(27)28/h3-13H,1-2H3,(H,23,24,25)

InChI Key

IEQRCWORKDNNAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02643684

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.569

Distribution Coefficient, logD

4.963

Water Solubility, LogSw

-5.99

Polar Surface Area

76.448

Acid Dissociation Constant (pKa)

16.35

Base Dissociation Constant (pKb)

7.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

3651-6389 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antimitotic Tubulin Library (17355 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with 3651-6389 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3651-6389?
Check Price and Availability of 3651-6389, 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 3651-6389 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3651-6389
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3651-6389
  • 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 3651-6389 available by request