D218-0033 Screening compound: 4-ethoxy-N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]benzamide

D218-0033 Screening compound: 4-ethoxy-N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]benzamide
D218-0033 Screening compound: 4-ethoxy-N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D218-0033
4-ethoxy-N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]benzamide

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

D218-0033

Molecular Formula

C22H28N2O3 (C22 H28 N2 O3)

Compound Name

4-ethoxy-N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]benzamide

IUPAC name

4-ethoxy-N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]benzamide

SMILES

CCOc(cc1)ccc1C(NCC(c(cc1)ccc1OC)N1CCCC1)=O

InChI

InChI=1S/C22H28N2O3/c1-3-27-20-12-8-18(9-13-20)22(25)23-16-21(24-14-4-5-15-24)17-6-10-19(26-2)11-7-17/h6-13,21H,3-5,14-16H2,1-2H3,(H,23,25)/t21-/m0/s1

InChI Key

AXUCLOBBWBGBDC-NRFANRHFSA-N

MDL Number (MFCD)

MFCD08548999

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.308

Distribution Coefficient, logD

3.006

Water Solubility, LogSw

-3.25

Polar Surface Area

42.674

Acid Dissociation Constant (pKa)

12.05

Base Dissociation Constant (pKb)

7.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

D218-0033 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • Ion Channels

References: we are preparing a list of scientific research reports with D218-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D218-0033?
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What is the minimum amount of D218-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D218-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D218-0033
  • 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 D218-0033 available by request