S722-1396 Screening compound: {[4-({1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]piperidin-4-yl}methyl)phenyl]methyl}(2-methoxyethyl)methylamine

S722-1396 Screening compound: {[4-({1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]piperidin-4-yl}methyl)phenyl]methyl}(2-methoxyethyl)methylamine
S722-1396 Screening compound: {[4-({1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]piperidin-4-yl}methyl)phenyl]methyl}(2-methoxyethyl)methylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound S722-1396
{[4-({1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]piperidin-4-yl}methyl)phenyl]methyl}(2-methoxyethyl)methylamine

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

S722-1396

Molecular Formula

C24H38N4O (C24 H38 N4 O)

Compound Name

{[4-({1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]piperidin-4-yl}methyl)phenyl]methyl}(2-methoxyethyl)methylamine

IUPAC name

{[4-({1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]piperidin-4-yl}methyl)phenyl]methyl}(2-methoxyethyl)methylamine

SMILES

CCn1ncc(CN2CCC(Cc3ccc(CN(C)CCOC)cc3)CC2)c1C

InChI

InChI=1S/C24H38N4O/c1-5-28-20(2)24(17-25-28)19-27-12-10-22(11-13-27)16-21-6-8-23(9-7-21)18-26(3)14-15-29-4/h6-9,17,22H,5,10-16,18-19H2,1-4H3

InChI Key

RTALFDCMAQKYMB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32226661

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.59

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.965

Distribution Coefficient, logD

-2.540

Water Solubility, LogSw

-2.80

Polar Surface Area

30.061

Acid Dissociation Constant (pKa)

25.44

Base Dissociation Constant (pKb)

12.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.50

S722-1396 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 S722-1396 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S722-1396?
Check Price and Availability of S722-1396, 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 S722-1396 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S722-1396
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S722-1396
  • 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 S722-1396 available by request