V020-4123 Screening compound: (2,4-DICHLOROPHENYL)[3-(2-METHYLPHENYL)-6,7-DIHYDRO-5H-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZIN-5-YL]METHANONE

V020-4123 Screening compound: (2,4-DICHLOROPHENYL)[3-(2-METHYLPHENYL)-6,7-DIHYDRO-5H-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZIN-5-YL]METHANONE
V020-4123 Screening compound: (2,4-DICHLOROPHENYL)[3-(2-METHYLPHENYL)-6,7-DIHYDRO-5H-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZIN-5-YL]METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-4123
(2,4-DICHLOROPHENYL)[3-(2-METHYLPHENYL)-6,7-DIHYDRO-5H-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZIN-5-YL]METHANONE

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

V020-4123

Molecular Formula

C18H14Cl2N4OS (C18 H14 Cl2 N4 OS)

Compound Name

(2,4-DICHLOROPHENYL)[3-(2-METHYLPHENYL)-6,7-DIHYDRO-5H-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZIN-5-YL]METHANONE

IUPAC name

n/a

SMILES

Cc(cccc1)c1-c1nnc2SCCN(C(c(ccc(Cl)c3)c3Cl)=O)n12

InChI

InChI=1S/C18H14Cl2N4OS/c1-11-4-2-3-5-13(11)16-21-22-18-24(16)23(8-9-26-18)17(25)14-7-6-12(19)10-15(14)20/h2-7,10H,8-9H2,1H3

InChI Key

UPIBTHXUPZKALR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14289368

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.890

Distribution Coefficient, logD

3.890

Water Solubility, LogSw

-4.37

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

16.70

V020-4123 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V020-4123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-4123?
Check Price and Availability of V020-4123, 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 V020-4123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-4123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-4123
  • 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 V020-4123 available by request