V009-1148 Screening compound: 4-cyclohexyl-3-(3,5-dimethoxyphenyl)-5-{[(3,4-dimethylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole

V009-1148 Screening compound: 4-cyclohexyl-3-(3,5-dimethoxyphenyl)-5-{[(3,4-dimethylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
V009-1148 Screening compound: 4-cyclohexyl-3-(3,5-dimethoxyphenyl)-5-{[(3,4-dimethylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-1148
4-cyclohexyl-3-(3,5-dimethoxyphenyl)-5-{[(3,4-dimethylphenyl)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

V009-1148

Molecular Formula

C25H31N3O2S (C25 H31 N3 O2 S)

Compound Name

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

IUPAC name

4-cyclohexyl-3-(35-dimethoxyphenyl)-5-{[(34-dimethylphenyl)methyl]sulfanyl}-4H-124-triazole

SMILES

Cc1c(C)cc(CSc2nnc(-c3cc(OC)cc(OC)c3)n2C2CCCCC2)cc1

InChI

InChI=1S/C25H31N3O2S/c1-17-10-11-19(12-18(17)2)16-31-25-27-26-24(28(25)21-8-6-5-7-9-21)20-13-22(29-3)15-23(14-20)30-4/h10-15,21H,5-9,16H2,1-4H3

InChI Key

RCUBBMVCDIBPBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19843482

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

437.61

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

6.633

Distribution Coefficient, logD

6.633

Water Solubility, LogSw

-5.60

Polar Surface Area

39.633

Acid Dissociation Constant (pKa)

17.61

Base Dissociation Constant (pKb)

4.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

V009-1148 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V009-1148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-1148?
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What is the minimum amount of V009-1148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-1148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-1148
  • 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 V009-1148 available by request