8003-0681 Screening compound: N-(3-{N'-[(E)-(3-iodophenyl)methylidene]hydrazinecarbonyl}phenyl)-4-methoxybenzamide

8003-0681 Screening compound: N-(3-{N'-[(E)-(3-iodophenyl)methylidene]hydrazinecarbonyl}phenyl)-4-methoxybenzamide
8003-0681 Screening compound: N-(3-{N'-[(E)-(3-iodophenyl)methylidene]hydrazinecarbonyl}phenyl)-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-0681
N-(3-{N'-[(E)-(3-iodophenyl)methylidene]hydrazinecarbonyl}phenyl)-4-methoxybenzamide

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

8003-0681

Molecular Formula

C22H18IN3O3 (C22 H18 IN3 O3)

Compound Name

N-(3-{N'-[(E)-(3-iodophenyl)methylidene]hydrazinecarbonyl}phenyl)-4-methoxybenzamide

IUPAC name

N-(3-{N'-[(E)-(3-iodophenyl)methylidene]hydrazinecarbonyl}phenyl)-4-methoxybenzamide

SMILES

COc(cc1)ccc1C(Nc1cccc(C(N/N=C/c2cccc(I)c2)=O)c1)=O

InChI

InChI=1S/C22H18IN3O3/c1-29-20-10-8-16(9-11-20)21(27)25-19-7-3-5-17(13-19)22(28)26-24-14-15-4-2-6-18(23)12-15/h2-14H,1H3,(H,25,27)(H,26,28)

InChI Key

PLBORGWBWLDDRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00742816

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.164

Distribution Coefficient, logD

5.152

Water Solubility, LogSw

-5.11

Polar Surface Area

66.189

Acid Dissociation Constant (pKa)

8.95

Base Dissociation Constant (pKb)

0.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

References: we are preparing a list of scientific research reports with 8003-0681 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-0681?
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What is the minimum amount of 8003-0681 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-0681
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-0681
  • 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 8003-0681 available by request