G964-0450 Screening compound: N-(2-chloro-4-methylphenyl)-4-[(3,5-dimethylpiperidin-1-yl)methyl]piperidine-1-carboxamide

G964-0450 Screening compound: N-(2-chloro-4-methylphenyl)-4-[(3,5-dimethylpiperidin-1-yl)methyl]piperidine-1-carboxamide
G964-0450 Screening compound: N-(2-chloro-4-methylphenyl)-4-[(3,5-dimethylpiperidin-1-yl)methyl]piperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G964-0450
N-(2-chloro-4-methylphenyl)-4-[(3,5-dimethylpiperidin-1-yl)methyl]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

G964-0450

Molecular Formula

C21H32ClN3O (C21 H32 ClN3 O)

Compound Name

N-(2-chloro-4-methylphenyl)-4-[(3,5-dimethylpiperidin-1-yl)methyl]piperidine-1-carboxamide

IUPAC name

N-(2-chloro-4-methylphenyl)-4-[(35-dimethylpiperidin-1-yl)methyl]piperidine-1-carboxamide

SMILES

CC1CN(CC(CC2)CCN2C(Nc(ccc(C)c2)c2Cl)=O)CC(C)C1

InChI

InChI=1S/C21H32ClN3O/c1-15-4-5-20(19(22)11-15)23-21(26)25-8-6-18(7-9-25)14-24-12-16(2)10-17(3)13-24/h4-5,11,16-18H,6-10,12-14H2,1-3H3,(H,23,26)

InChI Key

PDWLECSRYYRBQF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15077376

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.96

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.078

Distribution Coefficient, logD

2.050

Water Solubility, LogSw

-5.38

Polar Surface Area

28.609

Acid Dissociation Constant (pKa)

12.02

Base Dissociation Constant (pKb)

10.43

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

66.70

G964-0450 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G964-0450 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G964-0450?
Check Price and Availability of G964-0450, 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 G964-0450 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G964-0450
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G964-0450
  • 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 G964-0450 available by request