1038-3641 Screening compound: 4-ethoxy-N-(4-ethoxy-2-nitrophenyl)benzamide

1038-3641 Screening compound: 4-ethoxy-N-(4-ethoxy-2-nitrophenyl)benzamide
1038-3641 Screening compound: 4-ethoxy-N-(4-ethoxy-2-nitrophenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1038-3641
4-ethoxy-N-(4-ethoxy-2-nitrophenyl)benzamide

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

1038-3641

Molecular Formula

C17H18N2O5 (C17 H18 N2 O5)

Compound Name

4-ethoxy-N-(4-ethoxy-2-nitrophenyl)benzamide

IUPAC name

4-ethoxy-N-(4-ethoxy-2-nitrophenyl)benzamide

SMILES

CCOc(cc1)ccc1C(Nc(ccc(OCC)c1)c1[N+]([O-])=O)=O

InChI

InChI=1S/C17H18N2O5/c1-3-23-13-7-5-12(6-8-13)17(20)18-15-10-9-14(24-4-2)11-16(15)19(21)22/h5-11H,3-4H2,1-2H3,(H,18,20)

InChI Key

WELRWSANBIXMPP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00994220

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.34

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.120

Distribution Coefficient, logD

3.787

Water Solubility, LogSw

-4.23

Polar Surface Area

69.960

Acid Dissociation Constant (pKa)

7.34

Base Dissociation Constant (pKb)

-5.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

1038-3641 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 1038-3641 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1038-3641?
Check Price and Availability of 1038-3641, 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 1038-3641 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1038-3641
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1038-3641
  • 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 1038-3641 available by request