V007-3340 Screening compound: 4-benzyl-1-[5-methyl-1-(2-methylphenyl)-1H-1,2,4-triazole-3-carbonyl]piperidine

V007-3340 Screening compound: 4-benzyl-1-[5-methyl-1-(2-methylphenyl)-1H-1,2,4-triazole-3-carbonyl]piperidine
V007-3340 Screening compound: 4-benzyl-1-[5-methyl-1-(2-methylphenyl)-1H-1,2,4-triazole-3-carbonyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-3340
4-benzyl-1-[5-methyl-1-(2-methylphenyl)-1H-1,2,4-triazole-3-carbonyl]piperidine

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

V007-3340

Molecular Formula

C23H26N4O (C23 H26 N4 O)

Compound Name

4-benzyl-1-[5-methyl-1-(2-methylphenyl)-1H-1,2,4-triazole-3-carbonyl]piperidine

IUPAC name

4-benzyl-1-[5-methyl-1-(2-methylphenyl)-1H-124-triazole-3-carbonyl]piperidine

SMILES

Cc1nc(C(N2CCC(Cc3ccccc3)CC2)=O)nn1-c1c(C)cccc1

InChI

InChI=1S/C23H26N4O/c1-17-8-6-7-11-21(17)27-18(2)24-22(25-27)23(28)26-14-12-20(13-15-26)16-19-9-4-3-5-10-19/h3-11,20H,12-16H2,1-2H3

InChI Key

JIAVYBPCPXIZKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14287059

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

374.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.559

Distribution Coefficient, logD

4.559

Water Solubility, LogSw

-4.40

Polar Surface Area

41.014

Acid Dissociation Constant (pKa)

25.45

Base Dissociation Constant (pKb)

0.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

V007-3340 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V007-3340 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-3340?
Check Price and Availability of V007-3340, 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 V007-3340 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-3340
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-3340
  • 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 V007-3340 available by request