V007-7518 Screening compound: 3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazole

V007-7518 Screening compound: 3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazole
V007-7518 Screening compound: 3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-7518
3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-(4-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

V007-7518

Molecular Formula

C23H20ClN3OS (C23 H20 ClN3 OS)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1-n1c(SCc(cc2)ccc2Cl)nnc1-c1cc(OC)ccc1

InChI

InChI=1S/C23H20ClN3OS/c1-16-6-12-20(13-7-16)27-22(18-4-3-5-21(14-18)28-2)25-26-23(27)29-15-17-8-10-19(24)11-9-17/h3-14H,15H2,1-2H3

InChI Key

KXFQUWOPVJGXAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05518741

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

421.95

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.191

Distribution Coefficient, logD

6.191

Water Solubility, LogSw

-6.38

Polar Surface Area

32.256

Acid Dissociation Constant (pKa)

24.06

Base Dissociation Constant (pKb)

4.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

V007-7518 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V007-7518 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-7518?
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What is the minimum amount of V007-7518 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-7518
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-7518
  • 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 V007-7518 available by request