CM4182-4423 Screening compound: N-{[3-(4-{[4-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)oxolan-3-yl]methyl}acetamide

CM4182-4423 Screening compound: N-{[3-(4-{[4-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)oxolan-3-yl]methyl}acetamide
CM4182-4423 Screening compound: N-{[3-(4-{[4-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)oxolan-3-yl]methyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound CM4182-4423
N-{[3-(4-{[4-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)oxolan-3-yl]methyl}acetamide

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

CM4182-4423

Molecular Formula

C19H26F3N3O2 (C19 H26 F3 N3 O2)

Compound Name

N-{[3-(4-{[4-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)oxolan-3-yl]methyl}acetamide

IUPAC name

N-{[3-(4-{[4-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)oxolan-3-yl]methyl}acetamide

SMILES

CC(NCC1(COCC1)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1)=O

InChI

InChI=1S/C19H26F3N3O2/c1-15(26)23-13-18(6-11-27-14-18)25-9-7-24(8-10-25)12-16-2-4-17(5-3-16)19(20,21)22/h2-5H,6-14H2,1H3,(H,23,26)/t18-/m1/s1

InChI Key

VCPCAWAWPZFMSV-GOSISDBHSA-N

MDL Number (MFCD)

MFCD30465967

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.617

Distribution Coefficient, logD

1.500

Water Solubility, LogSw

-2.14

Polar Surface Area

40.369

Acid Dissociation Constant (pKa)

14.39

Base Dissociation Constant (pKb)

6.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.16

CM4182-4423 in Drug Discovery

Included in Screening Libraries

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

Soluble Diversity Library (15920 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with CM4182-4423 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM4182-4423?
Check Price and Availability of CM4182-4423, 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 CM4182-4423 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM4182-4423
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM4182-4423
  • 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 CM4182-4423 available by request