V010-9252 Screening compound: 4-(3,4-dichlorophenyl)-3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole

V010-9252 Screening compound: 4-(3,4-dichlorophenyl)-3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
V010-9252 Screening compound: 4-(3,4-dichlorophenyl)-3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-9252
4-(3,4-dichlorophenyl)-3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]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

V010-9252

Molecular Formula

C20H15Cl2N3O2S (C20 H15 Cl2 N3 O2 S)

Compound Name

4-(3,4-dichlorophenyl)-3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole

IUPAC name

4-(34-dichlorophenyl)-3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-124-triazole

SMILES

COc1ccc(CSc2nnc(-c3ccco3)n2-c(cc2)cc(Cl)c2Cl)cc1

InChI

InChI=1S/C20H15Cl2N3O2S/c1-26-15-7-4-13(5-8-15)12-28-20-24-23-19(18-3-2-10-27-18)25(20)14-6-9-16(21)17(22)11-14/h2-11H,12H2,1H3

InChI Key

DSYLQYPLKUQBNO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19776060

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

432.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.352

Distribution Coefficient, logD

5.352

Water Solubility, LogSw

-6.04

Polar Surface Area

40.835

Acid Dissociation Constant (pKa)

24.52

Base Dissociation Constant (pKb)

2.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with V010-9252 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-9252?
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What is the minimum amount of V010-9252 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-9252
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-9252
  • 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 V010-9252 available by request