V014-5609 Screening compound: 5-[3,5-bis(trifluoromethyl)benzoyl]-3-(2-methylphenyl)-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

V014-5609 Screening compound: 5-[3,5-bis(trifluoromethyl)benzoyl]-3-(2-methylphenyl)-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
V014-5609 Screening compound: 5-[3,5-bis(trifluoromethyl)benzoyl]-3-(2-methylphenyl)-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-5609
5-[3,5-bis(trifluoromethyl)benzoyl]-3-(2-methylphenyl)-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

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

V014-5609

Molecular Formula

C20H14F6N4OS (C20 H14 F6 N4 OS)

Compound Name

5-[3,5-bis(trifluoromethyl)benzoyl]-3-(2-methylphenyl)-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

IUPAC name

5-[35-bis(trifluoromethyl)benzoyl]-3-(2-methylphenyl)-5H6H7H-[124]triazolo[34-b][134]thiadiazine

SMILES

Cc(cccc1)c1-c1nnc2SCCN(C(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)=O)n12

InChI

InChI=1S/C20H14F6N4OS/c1-11-4-2-3-5-15(11)16-27-28-18-30(16)29(6-7-32-18)17(31)12-8-13(19(21,22)23)10-14(9-12)20(24,25)26/h2-5,8-10H,6-7H2,1H3

InChI Key

RWRSQSCCOGFELA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14289376

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

472.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.707

Distribution Coefficient, logD

4.707

Water Solubility, LogSw

-4.52

Polar Surface Area

39.990

Acid Dissociation Constant (pKa)

22.52

Base Dissociation Constant (pKb)

-1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with V014-5609 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-5609?
Check Price and Availability of V014-5609, 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 V014-5609 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-5609
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-5609
  • 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 V014-5609 available by request