V009-6391 Screening compound: N-(butan-2-yl)-1-[(3-chlorophenyl)methyl]-6-phenylpiperidine-3-carboxamide

V009-6391 Screening compound: N-(butan-2-yl)-1-[(3-chlorophenyl)methyl]-6-phenylpiperidine-3-carboxamide
V009-6391 Screening compound: N-(butan-2-yl)-1-[(3-chlorophenyl)methyl]-6-phenylpiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-6391
N-(butan-2-yl)-1-[(3-chlorophenyl)methyl]-6-phenylpiperidine-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

V009-6391

Molecular Formula

C23H29ClN2O (C23 H29 ClN2 O)

Compound Name

N-(butan-2-yl)-1-[(3-chlorophenyl)methyl]-6-phenylpiperidine-3-carboxamide

IUPAC name

N-(butan-2-yl)-1-[(3-chlorophenyl)methyl]-6-phenylpiperidine-3-carboxamide

SMILES

CCC(C)NC(C(CC1)CN(Cc2cccc(Cl)c2)C1c1ccccc1)=O

InChI

InChI=1S/C23H29ClN2O/c1-3-17(2)25-23(27)20-12-13-22(19-9-5-4-6-10-19)26(16-20)15-18-8-7-11-21(24)14-18/h4-11,14,17,20,22H,3,12-13,15-16H2,1-2H3,(H,25,27)

InChI Key

VVJMFUZZRXYGJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19931826

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

384.95

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.075

Distribution Coefficient, logD

4.910

Water Solubility, LogSw

-5.26

Polar Surface Area

27.619

Acid Dissociation Constant (pKa)

13.86

Base Dissociation Constant (pKb)

7.06

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

43.48

V009-6391 in Drug Discovery

Included in Screening Libraries

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

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 V009-6391 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-6391?
Check Price and Availability of V009-6391, 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 V009-6391 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-6391
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-6391
  • 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 V009-6391 available by request