8002-0767 Screening compound: 4-fluoro-N'-[(E)-{5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl}methylidene]benzohydrazide

8002-0767 Screening compound: 4-fluoro-N'-[(E)-{5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl}methylidene]benzohydrazide
8002-0767 Screening compound: 4-fluoro-N'-[(E)-{5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl}methylidene]benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-0767
4-fluoro-N'-[(E)-{5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl}methylidene]benzohydrazide

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

8002-0767

Molecular Formula

C19H11FN4O4S2 (C19 H11 FN4 O4 S2)

Compound Name

4-fluoro-N'-[(E)-{5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl}methylidene]benzohydrazide

IUPAC name

4-fluoro-N'-[(E)-{5-[(6-nitro-13-benzothiazol-2-yl)sulfanyl]furan-2-yl}methylidene]benzohydrazide

SMILES

[O-][N+](c(cc1)cc2c1nc(Sc1ccc(/C=N/NC(c(cc3)ccc3F)=O)o1)s2)=O

InChI

InChI=1S/C19H11FN4O4S2/c20-12-3-1-11(2-4-12)18(25)23-21-10-14-6-8-17(28-14)30-19-22-15-7-5-13(24(26)27)9-16(15)29-19/h1-10H,(H,23,25)

InChI Key

UTOXGZQWUOMUIS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00741996

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.45

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.669

Distribution Coefficient, logD

5.662

Water Solubility, LogSw

-5.96

Polar Surface Area

85.808

Acid Dissociation Constant (pKa)

9.21

Base Dissociation Constant (pKb)

-2.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8002-0767 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 8002-0767 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-0767?
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What is the minimum amount of 8002-0767 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-0767
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-0767
  • 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 8002-0767 available by request