V003-6719 Screening compound: 2-[({2-[(2-chloro-4-fluorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-5-(methylsulfanyl)-1,3,4-thiadiazole

V003-6719 Screening compound: 2-[({2-[(2-chloro-4-fluorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-5-(methylsulfanyl)-1,3,4-thiadiazole
V003-6719 Screening compound: 2-[({2-[(2-chloro-4-fluorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-5-(methylsulfanyl)-1,3,4-thiadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-6719
2-[({2-[(2-chloro-4-fluorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-5-(methylsulfanyl)-1,3,4-thiadiazole

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

V003-6719

Molecular Formula

C14H11ClFN3S4 (C14 H11 ClFN3 S4)

Compound Name

2-[({2-[(2-chloro-4-fluorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-5-(methylsulfanyl)-1,3,4-thiadiazole

IUPAC name

2-[({2-[(2-chloro-4-fluorophenyl)methyl]-13-thiazol-4-yl}methyl)sulfanyl]-5-(methylsulfanyl)-134-thiadiazole

SMILES

CSc1nnc(SCc2csc(Cc(ccc(F)c3)c3Cl)n2)s1

InChI

InChI=1S/C14H11ClFN3S4/c1-20-13-18-19-14(23-13)22-7-10-6-21-12(17-10)4-8-2-3-9(16)5-11(8)15/h2-3,5-6H,4,7H2,1H3

InChI Key

JSQXDWQCHDIZHA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19945055

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.98

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.920

Distribution Coefficient, logD

5.920

Water Solubility, LogSw

-6.24

Polar Surface Area

32.917

Acid Dissociation Constant (pKa)

27.45

Base Dissociation Constant (pKb)

2.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

References: we are preparing a list of scientific research reports with V003-6719 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-6719?
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What is the minimum amount of V003-6719 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-6719
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-6719
  • 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 V003-6719 available by request