F921-0105 Screening compound: N-(1-benzylpiperidin-4-yl)-1-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]piperidine-4-carboxamide

F921-0105 Screening compound: N-(1-benzylpiperidin-4-yl)-1-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]piperidine-4-carboxamide
F921-0105 Screening compound: N-(1-benzylpiperidin-4-yl)-1-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F921-0105
N-(1-benzylpiperidin-4-yl)-1-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]piperidine-4-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

F921-0105

Molecular Formula

C29H37N5O (C29 H37 N5 O)

Compound Name

N-(1-benzylpiperidin-4-yl)-1-[3-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]piperidine-4-carboxamide

IUPAC name

N-(1-benzylpiperidin-4-yl)-1-[3-(25-dimethyl-1H-pyrrol-1-yl)pyridin-2-yl]piperidine-4-carboxamide

SMILES

Cc1ccc(C)n1-c1cccnc1N(CC1)CCC1C(NC1CCN(Cc2ccccc2)CC1)=O

InChI

InChI=1S/C29H37N5O/c1-22-10-11-23(2)34(22)27-9-6-16-30-28(27)33-19-12-25(13-20-33)29(35)31-26-14-17-32(18-15-26)21-24-7-4-3-5-8-24/h3-11,16,25-26H,12-15,17-21H2,1-2H3,(H,31,35)

InChI Key

HJNGZOMYQILZEK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14972273

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.65

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.719

Distribution Coefficient, logD

2.162

Water Solubility, LogSw

-3.84

Polar Surface Area

42.939

Acid Dissociation Constant (pKa)

15.70

Base Dissociation Constant (pKb)

8.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.80

F921-0105 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

CNS Targets (44014 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F921-0105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F921-0105?
Check Price and Availability of F921-0105, 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 F921-0105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F921-0105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F921-0105
  • 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 F921-0105 available by request