V011-3513 Screening compound: 3-(4-methoxyphenyl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(2-methylphenyl)-4H-1,2,4-triazole

V011-3513 Screening compound: 3-(4-methoxyphenyl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(2-methylphenyl)-4H-1,2,4-triazole
V011-3513 Screening compound: 3-(4-methoxyphenyl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(2-methylphenyl)-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-3513
3-(4-methoxyphenyl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(2-methylphenyl)-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

V011-3513

Molecular Formula

C24H23N3O2S (C24 H23 N3 O2 S)

Compound Name

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

IUPAC name

3-(4-methoxyphenyl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(2-methylphenyl)-4H-124-triazole

SMILES

Cc(cccc1)c1-n1c(SCc2cc(OC)ccc2)nnc1-c(cc1)ccc1OC

InChI

InChI=1S/C24H23N3O2S/c1-17-7-4-5-10-22(17)27-23(19-11-13-20(28-2)14-12-19)25-26-24(27)30-16-18-8-6-9-21(15-18)29-3/h4-15H,16H2,1-3H3

InChI Key

CERFOWSXHUORRH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19843946

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

417.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.786

Distribution Coefficient, logD

5.786

Water Solubility, LogSw

-5.64

Polar Surface Area

39.499

Acid Dissociation Constant (pKa)

24.52

Base Dissociation Constant (pKb)

3.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with V011-3513 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-3513?
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What is the minimum amount of V011-3513 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-3513
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-3513
  • 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 V011-3513 available by request