V017-9488 Screening compound: N1-butyl-6-(4-fluoro-3-methylphenyl)-N3-[(pyridin-3-yl)methyl]piperidine-1,3-dicarboxamide

V017-9488 Screening compound: N1-butyl-6-(4-fluoro-3-methylphenyl)-N3-[(pyridin-3-yl)methyl]piperidine-1,3-dicarboxamide
V017-9488 Screening compound: N1-butyl-6-(4-fluoro-3-methylphenyl)-N3-[(pyridin-3-yl)methyl]piperidine-1,3-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-9488
N1-butyl-6-(4-fluoro-3-methylphenyl)-N3-[(pyridin-3-yl)methyl]piperidine-1,3-dicarboxamide

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

V017-9488

Molecular Formula

C24H31FN4O2 (C24 H31 FN4 O2)

Compound Name

N1-butyl-6-(4-fluoro-3-methylphenyl)-N3-[(pyridin-3-yl)methyl]piperidine-1,3-dicarboxamide

IUPAC name

N1-butyl-6-(4-fluoro-3-methylphenyl)-N3-[(pyridin-3-yl)methyl]piperidine-13-dicarboxamide

SMILES

CCCCNC(N(CC(CC1)C(NCc2cnccc2)=O)C1c(cc1)cc(C)c1F)=O

InChI

InChI=1S/C24H31FN4O2/c1-3-4-12-27-24(31)29-16-20(23(30)28-15-18-6-5-11-26-14-18)8-10-22(29)19-7-9-21(25)17(2)13-19/h5-7,9,11,13-14,20,22H,3-4,8,10,12,15-16H2,1-2H3,(H,27,31)(H,28,30)

InChI Key

SJBUKMRFQGAHCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19927300

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

426.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.928

Distribution Coefficient, logD

3.926

Water Solubility, LogSw

-3.54

Polar Surface Area

60.430

Acid Dissociation Constant (pKa)

12.47

Base Dissociation Constant (pKb)

5.15

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

45.83

V017-9488 in Drug Discovery

Included in Screening Libraries

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

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V017-9488 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-9488?
Check Price and Availability of V017-9488, 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 V017-9488 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-9488
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-9488
  • 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 V017-9488 available by request