F345-0014 Screening compound: 4-{[(butan-2-yl)carbamoyl]methyl}-N-(3-chlorophenyl)piperidine-1-carboxamide

F345-0014 Screening compound: 4-{[(butan-2-yl)carbamoyl]methyl}-N-(3-chlorophenyl)piperidine-1-carboxamide
F345-0014 Screening compound: 4-{[(butan-2-yl)carbamoyl]methyl}-N-(3-chlorophenyl)piperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F345-0014
4-{[(butan-2-yl)carbamoyl]methyl}-N-(3-chlorophenyl)piperidine-1-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

F345-0014

Molecular Formula

C18H26ClN3O2 (C18 H26 ClN3 O2)

Compound Name

4-{[(butan-2-yl)carbamoyl]methyl}-N-(3-chlorophenyl)piperidine-1-carboxamide

IUPAC name

4-{[(butan-2-yl)carbamoyl]methyl}-N-(3-chlorophenyl)piperidine-1-carboxamide

SMILES

CCC(C)NC(CC(CC1)CCN1C(Nc1cccc(Cl)c1)=O)=O

InChI

InChI=1S/C18H26ClN3O2/c1-3-13(2)20-17(23)11-14-7-9-22(10-8-14)18(24)21-16-6-4-5-15(19)12-16/h4-6,12-14H,3,7-11H2,1-2H3,(H,20,23)(H,21,24)/t13-/m0/s1

InChI Key

HGIRLHSYHPFUFD-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD27117080

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.88

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.701

Distribution Coefficient, logD

3.701

Water Solubility, LogSw

-4.05

Polar Surface Area

49.620

Acid Dissociation Constant (pKa)

12.15

Base Dissociation Constant (pKb)

4.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.60

F345-0014 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Immune system
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F345-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F345-0014?
Check Price and Availability of F345-0014, 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 F345-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F345-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F345-0014
  • 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 F345-0014 available by request