V007-6655 Screening compound: 3-{[(3,4-dimethylphenyl)methyl]sulfanyl}-5-(2-fluorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazole

V007-6655 Screening compound: 3-{[(3,4-dimethylphenyl)methyl]sulfanyl}-5-(2-fluorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazole
V007-6655 Screening compound: 3-{[(3,4-dimethylphenyl)methyl]sulfanyl}-5-(2-fluorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-6655
3-{[(3,4-dimethylphenyl)methyl]sulfanyl}-5-(2-fluorophenyl)-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

V007-6655

Molecular Formula

C24H22FN3S (C24 H22 FN3 S)

Compound Name

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

IUPAC name

3-{[(34-dimethylphenyl)methyl]sulfanyl}-5-(2-fluorophenyl)-4-(2-methylphenyl)-4H-124-triazole

SMILES

Cc1c(C)cc(CSc2nnc(-c(cccc3)c3F)n2-c2c(C)cccc2)cc1

InChI

InChI=1S/C24H22FN3S/c1-16-12-13-19(14-18(16)3)15-29-24-27-26-23(20-9-5-6-10-21(20)25)28(24)22-11-7-4-8-17(22)2/h4-14H,15H2,1-3H3

InChI Key

DWKCHWSKIMMRPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19843754

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

403.52

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.499

Distribution Coefficient, logD

6.499

Water Solubility, LogSw

-6.05

Polar Surface Area

24.412

Acid Dissociation Constant (pKa)

24.52

Base Dissociation Constant (pKb)

2.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with V007-6655 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-6655?
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What is the minimum amount of V007-6655 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-6655
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-6655
  • 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 V007-6655 available by request