3764-6420 Screening compound: 2-(4-butylphenyl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]quinazolin-4-amine

3764-6420 Screening compound: 2-(4-butylphenyl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]quinazolin-4-amine
3764-6420 Screening compound: 2-(4-butylphenyl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]quinazolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3764-6420
2-(4-butylphenyl)-N-[3-(4-ethoxyphenoxy)-5-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

3764-6420

Molecular Formula

C32H30N4O4 (C32 H30 N4 O4)

Compound Name

2-(4-butylphenyl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]quinazolin-4-amine

IUPAC name

2-(4-butylphenyl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]quinazolin-4-amine

SMILES

CCCCc(cc1)ccc1-c1nc2ccccc2c(Nc2cc([N+]([O-])=O)cc(Oc(cc3)ccc3OCC)c2)n1

InChI

InChI=1S/C32H30N4O4/c1-3-5-8-22-11-13-23(14-12-22)31-34-30-10-7-6-9-29(30)32(35-31)33-24-19-25(36(37)38)21-28(20-24)40-27-17-15-26(16-18-27)39-4-2/h6-7,9-21H,3-5,8H2,1-2H3,(H,33,34,35)

InChI Key

NZEJTSIAQRYLQB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02643822

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

534.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

10.224

Distribution Coefficient, logD

9.966

Water Solubility, LogSw

-5.99

Polar Surface Area

75.058

Acid Dissociation Constant (pKa)

16.72

Base Dissociation Constant (pKb)

7.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

3764-6420 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 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
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 3764-6420 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3764-6420?
Check Price and Availability of 3764-6420, 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 3764-6420 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3764-6420
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3764-6420
  • 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 3764-6420 available by request