V015-2801 Screening compound: 1-(2,5-dimethoxyphenyl)-2-{[5-methyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-ethanone

V015-2801 Screening compound: 1-(2,5-dimethoxyphenyl)-2-{[5-methyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-ethanone
V015-2801 Screening compound: 1-(2,5-dimethoxyphenyl)-2-{[5-methyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-2801
1-(2,5-dimethoxyphenyl)-2-{[5-methyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-ethanone

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

V015-2801

Molecular Formula

C20H21N3O3S (C20 H21 N3 O3 S)

Compound Name

1-(2,5-dimethoxyphenyl)-2-{[5-methyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-ethanone

IUPAC name

1-(25-dimethoxyphenyl)-2-{[5-methyl-4-(3-methylphenyl)-4H-124-triazol-3-yl]sulfanyl}ethan-1-one

SMILES

Cc(n1-c2cc(C)ccc2)nnc1SCC(c(cc(cc1)OC)c1OC)=O

InChI

InChI=1S/C20H21N3O3S/c1-13-6-5-7-15(10-13)23-14(2)21-22-20(23)27-12-18(24)17-11-16(25-3)8-9-19(17)26-4/h5-11H,12H2,1-4H3

InChI Key

FBKJVRULXHPKLV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15250414

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

383.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.346

Distribution Coefficient, logD

3.346

Water Solubility, LogSw

-3.62

Polar Surface Area

54.182

Acid Dissociation Constant (pKa)

17.41

Base Dissociation Constant (pKb)

2.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

V015-2801 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Antiparasite Library (23996 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal
  • Nervous system
Agro:
  • Agro
  • Agro
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with V015-2801 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-2801?
Check Price and Availability of V015-2801, 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 V015-2801 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-2801
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-2801
  • 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 V015-2801 available by request