V011-5405 Screening compound: 3,4-bis(2-chlorophenyl)-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazole

V011-5405 Screening compound: 3,4-bis(2-chlorophenyl)-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazole
V011-5405 Screening compound: 3,4-bis(2-chlorophenyl)-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-5405
3,4-bis(2-chlorophenyl)-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-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

V011-5405

Molecular Formula

C22H14Cl2F3N3S (C22 H14 Cl2 F3 N3 S)

Compound Name

3,4-bis(2-chlorophenyl)-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazole

IUPAC name

34-bis(2-chlorophenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-124-triazole

SMILES

FC(c1cccc(CSc2nnc(-c(cccc3)c3Cl)n2-c(cccc2)c2Cl)c1)(F)F

InChI

InChI=1S/C22H14Cl2F3N3S/c23-17-9-2-1-8-16(17)20-28-29-21(30(20)19-11-4-3-10-18(19)24)31-13-14-6-5-7-15(12-14)22(25,26)27/h1-12H,13H2

InChI Key

ASZPXHOUXHHYTA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19772701

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

480.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.769

Distribution Coefficient, logD

6.769

Water Solubility, LogSw

-6.80

Polar Surface Area

24.412

Acid Dissociation Constant (pKa)

24.13

Base Dissociation Constant (pKb)

1.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.09

References: we are preparing a list of scientific research reports with V011-5405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-5405?
Check Price and Availability of V011-5405, 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 V011-5405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-5405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-5405
  • 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 V011-5405 available by request