3764-6722 Screening compound: ethyl 4-{[3-(4-ethoxyphenoxy)-5-nitrophenyl]amino}quinazoline-2-carboxylate

3764-6722 Screening compound: ethyl 4-{[3-(4-ethoxyphenoxy)-5-nitrophenyl]amino}quinazoline-2-carboxylate
3764-6722 Screening compound: ethyl 4-{[3-(4-ethoxyphenoxy)-5-nitrophenyl]amino}quinazoline-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3764-6722
ethyl 4-{[3-(4-ethoxyphenoxy)-5-nitrophenyl]amino}quinazoline-2-carboxylate

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

3764-6722

Molecular Formula

C25H22N4O6 (C25 H22 N4 O6)

Compound Name

ethyl 4-{[3-(4-ethoxyphenoxy)-5-nitrophenyl]amino}quinazoline-2-carboxylate

IUPAC name

ethyl 4-{[3-(4-ethoxyphenoxy)-5-nitrophenyl]amino}quinazoline-2-carboxylate

SMILES

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

InChI

InChI=1S/C25H22N4O6/c1-3-33-18-9-11-19(12-10-18)35-20-14-16(13-17(15-20)29(31)32)26-23-21-7-5-6-8-22(21)27-24(28-23)25(30)34-4-2/h5-15H,3-4H2,1-2H3,(H,26,27,28)

InChI Key

ZDIVAYZZQFKAPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02644066

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.47

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

6.382

Distribution Coefficient, logD

6.382

Water Solubility, LogSw

-5.74

Polar Surface Area

96.083

Acid Dissociation Constant (pKa)

15.05

Base Dissociation Constant (pKb)

1.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

3764-6722 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antimitotic Tubulin Library (17355 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3764-6722 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3764-6722?
Check Price and Availability of 3764-6722, 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 3764-6722 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3764-6722
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3764-6722
  • 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 3764-6722 available by request