8004-6790 Screening compound: N'~1~-[(E)-1-(5-bromo-2-thienyl)methylidene]-3,4,5-trimethoxybenzohydrazide

8004-6790 Screening compound: N'~1~-[(E)-1-(5-bromo-2-thienyl)methylidene]-3,4,5-trimethoxybenzohydrazide
8004-6790 Screening compound: N'~1~-[(E)-1-(5-bromo-2-thienyl)methylidene]-3,4,5-trimethoxybenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-6790
N'~1~-[(E)-1-(5-bromo-2-thienyl)methylidene]-3,4,5-trimethoxybenzohydrazide

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

8004-6790

Molecular Formula

C15H15BrN2O4S (C15 H15 BrN2 O4 S)

Compound Name

N'~1~-[(E)-1-(5-bromo-2-thienyl)methylidene]-3,4,5-trimethoxybenzohydrazide

IUPAC name

N'-[(E)-(5-bromothiophen-2-yl)methylidene]-345-trimethoxybenzohydrazide

SMILES

COc1cc(C(N/N=C/c(s2)ccc2Br)=O)cc(OC)c1OC

InChI

InChI=1S/C15H15BrN2O4S/c1-20-11-6-9(7-12(21-2)14(11)22-3)15(19)18-17-8-10-4-5-13(16)23-10/h4-8H,1-3H3,(H,18,19)

InChI Key

AUWQIHUKGPVZDN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00558181

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.27

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.642

Distribution Coefficient, logD

3.642

Water Solubility, LogSw

-4.01

Polar Surface Area

59.550

Acid Dissociation Constant (pKa)

10.77

Base Dissociation Constant (pKb)

-1.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

8004-6790 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8004-6790 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-6790?
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What is the minimum amount of 8004-6790 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-6790
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-6790
  • 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 8004-6790 available by request