8007-4253 Screening compound: 5-[(2E)-2-[(2-fluorophenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-1,2-thiazole-4-carbonitrile

8007-4253 Screening compound: 5-[(2E)-2-[(2-fluorophenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-1,2-thiazole-4-carbonitrile
8007-4253 Screening compound: 5-[(2E)-2-[(2-fluorophenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-1,2-thiazole-4-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-4253
5-[(2E)-2-[(2-fluorophenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-1,2-thiazole-4-carbonitrile

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

8007-4253

Molecular Formula

C12H9FN4S2 (C12 H9 FN4 S2)

Compound Name

5-[(2E)-2-[(2-fluorophenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-1,2-thiazole-4-carbonitrile

IUPAC name

5-[(2E)-2-[(2-fluorophenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-12-thiazole-4-carbonitrile

SMILES

CSc1nsc(N/N=C/c(cccc2)c2F)c1C#N

InChI

InChI=1S/C12H9FN4S2/c1-18-12-9(6-14)11(19-17-12)16-15-7-8-4-2-3-5-10(8)13/h2-5,7,16H,1H3

InChI Key

ZUIBIYYXGXPADH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01239794

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.793

Distribution Coefficient, logD

3.792

Water Solubility, LogSw

-4.21

Polar Surface Area

47.831

Acid Dissociation Constant (pKa)

10.57

Base Dissociation Constant (pKb)

1.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

8007-4253 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 8007-4253 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-4253?
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What is the minimum amount of 8007-4253 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-4253
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-4253
  • 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 8007-4253 available by request