V022-4872 Screening compound: 2-{1-[(2-chlorophenyl)methyl]piperidin-4-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methylpyridine-3-carboxamide

V022-4872 Screening compound: 2-{1-[(2-chlorophenyl)methyl]piperidin-4-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methylpyridine-3-carboxamide
V022-4872 Screening compound: 2-{1-[(2-chlorophenyl)methyl]piperidin-4-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methylpyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-4872
2-{1-[(2-chlorophenyl)methyl]piperidin-4-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methylpyridine-3-carboxamide

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

V022-4872

Molecular Formula

C29H34ClN3O3 (C29 H34 ClN3 O3)

Compound Name

2-{1-[(2-chlorophenyl)methyl]piperidin-4-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methylpyridine-3-carboxamide

IUPAC name

2-{1-[(2-chlorophenyl)methyl]piperidin-4-yl}-N-[2-(34-dimethoxyphenyl)ethyl]-6-methylpyridine-3-carboxamide

SMILES

Cc1ccc(C(NCCc(cc2)cc(OC)c2OC)=O)c(C2CCN(Cc(cccc3)c3Cl)CC2)n1

InChI

InChI=1S/C29H34ClN3O3/c1-20-8-10-24(29(34)31-15-12-21-9-11-26(35-2)27(18-21)36-3)28(32-20)22-13-16-33(17-14-22)19-23-6-4-5-7-25(23)30/h4-11,18,22H,12-17,19H2,1-3H3,(H,31,34)

InChI Key

HWAMLIWDZKKKGS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19929131

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

508.06

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.130

Distribution Coefficient, logD

4.561

Water Solubility, LogSw

-5.39

Polar Surface Area

52.408

Acid Dissociation Constant (pKa)

12.13

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.90

V022-4872 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V022-4872 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-4872?
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What is the minimum amount of V022-4872 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-4872
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-4872
  • 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 V022-4872 available by request