8004-6737 Screening compound: 2-[(E)-1-(4-bromo-2-thienyl)methylidene]-1-hydrazinecarboxamide

8004-6737 Screening compound: 2-[(E)-1-(4-bromo-2-thienyl)methylidene]-1-hydrazinecarboxamide
8004-6737 Screening compound: 2-[(E)-1-(4-bromo-2-thienyl)methylidene]-1-hydrazinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-6737
2-[(E)-1-(4-bromo-2-thienyl)methylidene]-1-hydrazinecarboxamide

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

8004-6737

Molecular Formula

C6H6BrN3OS (C6 H6 BrN3 OS)

Compound Name

2-[(E)-1-(4-bromo-2-thienyl)methylidene]-1-hydrazinecarboxamide

IUPAC name

[(E)-[(4-bromothiophen-2-yl)methylidene]amino]urea

SMILES

NC(N/N=C/c1cc(Br)cs1)=O

InChI

InChI=1S/C6H6BrN3OS/c7-4-1-5(12-3-4)2-9-10-6(8)11/h1-3H,(H3,8,10,11)

InChI Key

JZOFYYASDGJJAH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00466779

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

248.1

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.184

Distribution Coefficient, logD

2.184

Water Solubility, LogSw

-2.57

Polar Surface Area

57.542

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

-0.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8004-6737 in Drug Discovery

Included in Screening Libraries

Crystallographic and 19F NMR fragment-libraries (624 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8004-6737 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-6737?
Check Price and Availability of 8004-6737, 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 8004-6737 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-6737
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-6737
  • 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 8004-6737 available by request