V023-2613 Screening compound: 3-(2-chlorophenyl)-5-{[(2,4-dichlorophenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazole

V023-2613 Screening compound: 3-(2-chlorophenyl)-5-{[(2,4-dichlorophenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazole
V023-2613 Screening compound: 3-(2-chlorophenyl)-5-{[(2,4-dichlorophenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-2613
3-(2-chlorophenyl)-5-{[(2,4-dichlorophenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazole

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

V023-2613

Molecular Formula

C21H13Cl3FN3S (C21 H13 Cl3 FN3 S)

Compound Name

3-(2-chlorophenyl)-5-{[(2,4-dichlorophenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazole

IUPAC name

3-(2-chlorophenyl)-5-{[(24-dichlorophenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-124-triazole

SMILES

Fc(cccc1)c1-n1c(SCc(ccc(Cl)c2)c2Cl)nnc1-c(cccc1)c1Cl

InChI

InChI=1S/C21H13Cl3FN3S/c22-14-10-9-13(17(24)11-14)12-29-21-27-26-20(15-5-1-2-6-16(15)23)28(21)19-8-4-3-7-18(19)25/h1-11H,12H2

InChI Key

FAYLUEBWCIRDSL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04631388

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

464.78

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.983

Distribution Coefficient, logD

6.983

Water Solubility, LogSw

-6.81

Polar Surface Area

24.412

Acid Dissociation Constant (pKa)

23.67

Base Dissociation Constant (pKb)

1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

References: we are preparing a list of scientific research reports with V023-2613 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-2613?
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What is the minimum amount of V023-2613 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-2613
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-2613
  • 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 V023-2613 available by request