V017-7671 Screening compound: {4-[(4-benzylpiperidino)methyl]phenyl}(morpholino)methanone

V017-7671 Screening compound: {4-[(4-benzylpiperidino)methyl]phenyl}(morpholino)methanone
V017-7671 Screening compound: {4-[(4-benzylpiperidino)methyl]phenyl}(morpholino)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-7671
{4-[(4-benzylpiperidino)methyl]phenyl}(morpholino)methanone

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

V017-7671

Molecular Formula

C24H30N2O2 (C24 H30 N2 O2)

Compound Name

{4-[(4-benzylpiperidino)methyl]phenyl}(morpholino)methanone

IUPAC name

4-{4-[(4-benzylpiperidin-1-yl)methyl]benzoyl}morpholine

SMILES

O=C(c1ccc(CN2CCC(Cc3ccccc3)CC2)cc1)N1CCOCC1

InChI

InChI=1S/C24H30N2O2/c27-24(26-14-16-28-17-15-26)23-8-6-22(7-9-23)19-25-12-10-21(11-13-25)18-20-4-2-1-3-5-20/h1-9,21H,10-19H2

InChI Key

YMPQDZSDENDACG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02636087

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

378.51

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

3.423

Distribution Coefficient, logD

2.498

Water Solubility, LogSw

-3.40

Polar Surface Area

28.256

Acid Dissociation Constant (pKa)

25.76

Base Dissociation Constant (pKb)

8.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.83

V017-7671 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

PI3K-Targeted Library (17255 compounds)

Proline Kinase Library (2105 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Targets:
  • GPCR
  • Kinases
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V017-7671 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-7671?
Check Price and Availability of V017-7671, 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 V017-7671 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-7671
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-7671
  • 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 V017-7671 available by request