8003-3498 Screening compound: 2-(3-chlorophenoxy)-N'-[(E)-(4-nitrothiophen-2-yl)methylidene]propanehydrazide

8003-3498 Screening compound: 2-(3-chlorophenoxy)-N'-[(E)-(4-nitrothiophen-2-yl)methylidene]propanehydrazide
8003-3498 Screening compound: 2-(3-chlorophenoxy)-N'-[(E)-(4-nitrothiophen-2-yl)methylidene]propanehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-3498
2-(3-chlorophenoxy)-N'-[(E)-(4-nitrothiophen-2-yl)methylidene]propanehydrazide

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

8003-3498

Molecular Formula

C14H12ClN3O4S (C14 H12 ClN3 O4 S)

Compound Name

2-(3-chlorophenoxy)-N'-[(E)-(4-nitrothiophen-2-yl)methylidene]propanehydrazide

IUPAC name

2-(3-chlorophenoxy)-N'-[(E)-(4-nitrothiophen-2-yl)methylidene]propanehydrazide

SMILES

CC(C(N/N=C/c1cc([N+]([O-])=O)cs1)=O)Oc1cccc(Cl)c1

InChI

InChI=1S/C14H12ClN3O4S/c1-9(22-12-4-2-3-10(15)5-12)14(19)17-16-7-13-6-11(8-23-13)18(20)21/h2-9H,1H3,(H,17,19)/t9-/m0/s1

InChI Key

NJQJZWPXYRTJMT-VIFPVBQESA-N

MDL Number (MFCD)

MFCD00735036

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.79

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.089

Distribution Coefficient, logD

4.089

Water Solubility, LogSw

-4.38

Polar Surface Area

76.743

Acid Dissociation Constant (pKa)

11.22

Base Dissociation Constant (pKb)

-0.03

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

14.30

8003-3498 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8003-3498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-3498?
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What is the minimum amount of 8003-3498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-3498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-3498
  • 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 8003-3498 available by request