7397-0066 Screening compound: N-[4-methoxy-3-(2-nitrobenzamido)phenyl]furan-2-carboxamide

7397-0066 Screening compound: N-[4-methoxy-3-(2-nitrobenzamido)phenyl]furan-2-carboxamide
7397-0066 Screening compound: N-[4-methoxy-3-(2-nitrobenzamido)phenyl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7397-0066
N-[4-methoxy-3-(2-nitrobenzamido)phenyl]furan-2-carboxamide

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

7397-0066

Molecular Formula

C19H15N3O6 (C19 H15 N3 O6)

Compound Name

N-[4-methoxy-3-(2-nitrobenzamido)phenyl]furan-2-carboxamide

IUPAC name

N-[4-methoxy-3-(2-nitrobenzamido)phenyl]furan-2-carboxamide

SMILES

COc(ccc(NC(c1ccco1)=O)c1)c1NC(c(cccc1)c1[N+]([O-])=O)=O

InChI

InChI=1S/C19H15N3O6/c1-27-16-9-8-12(20-19(24)17-7-4-10-28-17)11-14(16)21-18(23)13-5-2-3-6-15(13)22(25)26/h2-11H,1H3,(H,20,24)(H,21,23)

InChI Key

VDCZLUAYYUXPPP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04393677

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.34

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.767

Distribution Coefficient, logD

2.392

Water Solubility, LogSw

-3.66

Polar Surface Area

95.012

Acid Dissociation Constant (pKa)

7.26

Base Dissociation Constant (pKb)

0.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

7397-0066 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 7397-0066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7397-0066?
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What is the minimum amount of 7397-0066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7397-0066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7397-0066
  • 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 7397-0066 available by request