3617-3705 Screening compound: N-[4-(4-chloro-3-nitrobenzamido)-2-methoxyphenyl]-1-benzofuran-2-carboxamide

3617-3705 Screening compound: N-[4-(4-chloro-3-nitrobenzamido)-2-methoxyphenyl]-1-benzofuran-2-carboxamide
3617-3705 Screening compound: N-[4-(4-chloro-3-nitrobenzamido)-2-methoxyphenyl]-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3617-3705
N-[4-(4-chloro-3-nitrobenzamido)-2-methoxyphenyl]-1-benzofuran-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

3617-3705

Molecular Formula

C23H16ClN3O6 (C23 H16 ClN3 O6)

Compound Name

N-[4-(4-chloro-3-nitrobenzamido)-2-methoxyphenyl]-1-benzofuran-2-carboxamide

IUPAC name

N-[4-(4-chloro-3-nitrobenzamido)-2-methoxyphenyl]-1-benzofuran-2-carboxamide

SMILES

COc(cc(cc1)NC(c(cc2)cc([N+]([O-])=O)c2Cl)=O)c1NC(c1cc(cccc2)c2o1)=O

InChI

InChI=1S/C23H16ClN3O6/c1-32-20-12-15(25-22(28)14-6-8-16(24)18(10-14)27(30)31)7-9-17(20)26-23(29)21-11-13-4-2-3-5-19(13)33-21/h2-12H,1H3,(H,25,28)(H,26,29)

InChI Key

TZPPBVDLDPWXIZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02635958

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.85

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

5.082

Distribution Coefficient, logD

4.993

Water Solubility, LogSw

-5.72

Polar Surface Area

94.727

Acid Dissociation Constant (pKa)

8.04

Base Dissociation Constant (pKb)

1.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

References: we are preparing a list of scientific research reports with 3617-3705 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3617-3705?
Check Price and Availability of 3617-3705, 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 3617-3705 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3617-3705
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3617-3705
  • 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 3617-3705 available by request